1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine

C71H158N16 — CID 160912465

IUPAC1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine
SMILESCCN1CCC(N(C)C)CC1.CCN1CCC(N(CC)CC)C1.CCN1CCC(N(CC)CC)CC1.CCN1CCCC(N(C)C)C1.CCN1CCN(C(C)C)CC1.CCN1CCN(C)CC1.CCN1CC[C@@H](N(C)C)C1.CCN1CC[C@H](N(C)C)C1
InChIInChI=1S/C11H24N2.C10H22N2.3C9H20N2.2C8H18N2.C7H16N2/c1-4-12-9-7-11(8-10-12)13(5-2)6-3;1-4-11-8-7-10(9-11)12(5-2)6-3;1-4-11-7-5-9(6-8-11)10(2)3;1-4-10-5-7-11(8-6-10)9(2)3;1-4-11-7-5-6-9(8-11)10(2)3;2*1-4-10-6-5-8(7-10)9(2)3;1-3-9-6-4-8(2)5-7-9/h11H,4-10H2,1-3H3;10H,4-9H2,1-3H3;3*9H,4-8H2,1-3H3;2*8H,4-7H2,1-3H3;3-7H2,1-2H3/t;;;;;2*8-;/m.....10./s1
InChIKeySQYXKJJHXOERLM-MXYVGPDBSA-N
MW1236.16 g/mol
LogP7.87
Rot. Bonds19

About 1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine

1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine (PubChem CID 160912465) has the molecular formula C71H158N16 and a molecular weight of 1236.16 g/mol. Its IUPAC name is 1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine
PubChem CID160912465
Molecular FormulaC71H158N16
Molecular Weight1236.16 g/mol
Exact Mass1235.29
IUPAC Name1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine
SMILESCCN1CCC(N(C)C)CC1.CCN1CCC(N(CC)CC)C1.CCN1CCC(N(CC)CC)CC1.CCN1CCCC(N(C)C)C1.CCN1CCN(C(C)C)CC1.CCN1CCN(C)CC1.CCN1CC[C@@H](N(C)C)C1.CCN1CC[C@H](N(C)C)C1
InChIInChI=1S/C11H24N2.C10H22N2.3C9H20N2.2C8H18N2.C7H16N2/c1-4-12-9-7-11(8-10-12)13(5-2)6-3;1-4-11-8-7-10(9-11)12(5-2)6-3;1-4-11-7-5-9(6-8-11)10(2)3;1-4-10-5-7-11(8-6-10)9(2)3;1-4-11-7-5-6-9(8-11)10(2)3;2*1-4-10-6-5-8(7-10)9(2)3;1-3-9-6-4-8(2)5-7-9/h11H,4-10H2,1-3H3;10H,4-9H2,1-3H3;3*9H,4-8H2,1-3H3;2*8H,4-7H2,1-3H3;3-7H2,1-2H3/t;;;;;2*8-;/m.....10./s1
InChIKeySQYXKJJHXOERLM-MXYVGPDBSA-N
XLogP7.87
TPSA51.84 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds19
Heavy Atoms87
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001236.16
LogP ≤ 57.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze 1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine with MolForge

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Launch Full Analysis

Related Compounds

1-Methyl-2-(piperidin-1-ylmethyl)piperidine;1-[(1-methylpyrrolidin-2-yl)methyl]piperidine;1-methyl-2-(pyrrolidin-1-ylmethyl)piperidine
CID 143456779
1,1-dimethyl-4-propan-2-ylpiperazin-1-ium;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;1-methyl-4-propan-2-ylpiperazine;bis(1-propan-2-ylpiperidine);1-propan-2-ylpyrrolidine
CID 157291580
1-Ethyl-4-methylpiperazine;tris(1-ethyl-4-methylpiperidine);bis(1-ethyl-3-methylpyrrolidine);1-ethylpiperidine;1-ethylpyrrolidine
CID 157530982
1,4-Bis(2-pyrrolidin-1-ylethyl)piperazine;1-(2-methylpropyl)-4-(2-pyrrolidin-1-ylethyl)piperazine;1-(2-methylpropyl)-4-(3-pyrrolidin-1-ylpropyl)piperazine;1-methyl-4-(2-pyrrolidin-1-ylethyl)piperazine;1-methyl-4-(3-pyrrolidin-1-ylpropyl)piperazine;bis(1-propyl-4-(2-pyrrolidin-1-ylethyl)piperazine);1-propyl-4-(3-pyrrolidin-1-ylpropyl)piperazine;1-(2-pyrrolidin-1-ylethyl)piperidine;1-(3-pyrrolidin-1-ylpropyl)piperidine
CID 157627723
1,4-diethylpiperazine;1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-N,N-di(propan-2-yl)piperidin-3-amine;1-ethyl-N,N-di(propan-2-yl)piperidin-4-amine;1-ethyl-N,N-di(propan-2-yl)pyrrolidin-3-amine;1-ethyl-N,N-dipropylpiperidin-3-amine;1-ethyl-N,N-dipropylpiperidin-4-amine;1-ethyl-N,N-dipropylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-3-amine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine
CID 158143071
1-tert-butyl-4-[2-(4-tert-butylpiperazin-1-yl)ethyl]piperazine;1-tert-butyl-4-[2-(1-tert-butylpiperidin-4-yl)ethyl]piperazine;(2R)-4-tert-butyl-1-[(1-tert-butylpiperidin-4-yl)methyl]-2-methylpiperazine;(2S)-4-tert-butyl-1-[(1-tert-butylpiperidin-4-yl)methyl]-2-methylpiperazine;1-tert-butyl-4-[[(3S)-1-tert-butylpyrrolidin-3-yl]methyl]piperazine;1-tert-butyl-4-[[(3R)-1-tert-butylpyrrolidin-3-yl]methyl]piperazine
CID 158499748
4-Tert-butyl-1,2-dimethylpiperazine;2-tert-butyl-5-methyl-2,5-diazabicyclo[2.2.1]heptane;bis(1-tert-butyl-4-methylpiperazine)
CID 158526159
2,2-Dimethyl-1,4-di(propan-2-yl)piperazine;2,3-dimethyl-1,4-di(propan-2-yl)piperazine;bis(2,6-dimethyl-1,4-di(propan-2-yl)piperazine);2,5-di(propan-2-yl)-2,5-diazabicyclo[2.2.1]heptane;1,4-di(propan-2-yl)piperazine;bis(2-methyl-1,4-di(propan-2-yl)piperazine)
CID 159395728
2,5-Dimethyl-2,5-diazabicyclo[2.2.1]heptane;2,5-dimethyl-2,5-diazabicyclo[2.2.2]octane;3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane
CID 159475883
1,1-dimethyl-4-propan-2-ylpiperazin-1-ium;N,N-dimethyl-1-propan-2-ylpiperidin-4-amine;N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;1,4-di(propan-2-yl)piperazine;methane;1-methyl-4-propan-2-ylpiperazine;bis(1-propan-2-ylpiperidine);1-propan-2-ylpyrrolidine
CID 159653810
8-Tert-butyl-3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2,5-di(propan-2-yl)-2,5-diazabicyclo[2.2.1]heptane;2,5-di(propan-2-yl)-2,5-diazabicyclo[2.2.2]octane
CID 159970504
N-butyl-N-methylbutan-1-amine;1,4-diethylpiperazine;N,N-dimethylpropan-1-amine;N-ethyl-N-methylpropan-1-amine;N-ethyl-N-methylpropan-2-amine;hexakis(1-ethylpiperidine);N-ethyl-N-propan-2-ylpropan-2-amine;1-ethylpyrrolidine;methane
CID 160178936

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine?
The IUPAC name of 1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine (CID 160912465) is 1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine.
What is the SMILES notation for 1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine?
The canonical SMILES for 1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine is CCN1CCC(N(C)C)CC1.CCN1CCC(N(CC)CC)C1.CCN1CCC(N(CC)CC)CC1.CCN1CCCC(N(C)C)C1.CCN1CCN(C(C)C)CC1.CCN1CCN(C)CC1.CCN1CC[C@@H](N(C)C)C1.CCN1CC[C@H](N(C)C)C1.
What is the InChIKey of 1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine?
The InChIKey is SQYXKJJHXOERLM-MXYVGPDBSA-N. The full InChI is InChI=1S/C11H24N2.C10H22N2.3C9H20N2.2C8H18N2.C7H16N2/c1-4-12-9-7-11(8-10-12)13(5-2)6-3;1-4-11-8-7-10(9-11)12(5-2)6-3;1-4-11-7-5-9(6-8-11)10(2)3;1-4-10-5-7-11(8-6-10)9(2)3;1-4-11-7-5-6-9(8-11)10(2)3;2*1-4-10-6-5-8(7-10)9(2)3;1-3-9-6-4-8(2)5-7-9/h11H,4-10H2,1-3H3;10H,4-9H2,1-3H3;3*9H,4-8H2,1-3H3;2*8H,4-7H2,1-3H3;3-7H2,1-2H3/t;;;;;2*8-;/m.....10./s1.
What are the key properties of 1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine?
1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine has a molecular weight of 1236.16 g/mol, XLogP of 7.87, 19 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N,N-dimethylpiperidin-3-amine;1-ethyl-N,N-dimethylpiperidin-4-amine;(3S)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;(3R)-1-ethyl-N,N-dimethylpyrrolidin-3-amine;1-ethyl-4-methylpiperazine;1-ethyl-4-propan-2-ylpiperazine;N,N,1-triethylpiperidin-4-amine;N,N,1-triethylpyrrolidin-3-amine is sourced from PubChem (CID 160912465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).