N-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine

C14H29N3 — CID 79313602

IUPACN-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine
SMILESCCN1CCCC1CN(C)C1CNCCC1C
InChIInChI=1S/C14H29N3/c1-4-17-9-5-6-13(17)11-16(3)14-10-15-8-7-12(14)2/h12-15H,4-11H2,1-3H3
InChIKeyKUHNPPFHUCYMMZ-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.40
Rot. Bonds4

About N-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine

N-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine (PubChem CID 79313602) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is N-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine.

Molecular Properties

Compound NameN-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine
PubChem CID79313602
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC NameN-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine
SMILESCCN1CCCC1CN(C)C1CNCCC1C
InChIInChI=1S/C14H29N3/c1-4-17-9-5-6-13(17)11-16(3)14-10-15-8-7-12(14)2/h12-15H,4-11H2,1-3H3
InChIKeyKUHNPPFHUCYMMZ-UHFFFAOYSA-N
XLogP1.40
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylpiperidin-4-amine
CID 79313995
N-[(1-ethylpyrrolidin-2-yl)methyl]pyrrolidin-3-amine
CID 79725125
2-(aminomethyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylcycloheptan-1-amine
CID 79303418
N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-piperidin-4-ylmethanesulfonamide
CID 79319252
2-(azetidin-3-yl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylacetamide
CID 79314252
1-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropan-2-ol
CID 112734110
4-[[(2S)-1-ethylpyrrolidin-2-yl]methyl-methylamino]butanoic acid
CID 124511772
1-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-N,2-dimethylpentane-1,2-diamine
CID 79319921
N-[(1-ethylpyrrolidin-2-yl)methyl]-N,6-dimethylpiperidine-2-carboxamide
CID 79319501
2-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-N-methyl-2,3-dihydro-1H-indene-1,2-diamine
CID 79313644
2-[[(1-ethylpyrrolidin-2-yl)methyl-methylamino]methyl]-4-methylcyclohexan-1-ol
CID 79313488
N-[[4-(aminomethyl)phenyl]methyl]-1-(1-ethylpyrrolidin-2-yl)-N-methylmethanamine
CID 79303419

Frequently Asked Questions

What is the IUPAC name of N-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine?
The IUPAC name of N-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine (CID 79313602) is N-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine.
What is the SMILES notation for N-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine?
The canonical SMILES for N-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine is CCN1CCCC1CN(C)C1CNCCC1C.
What is the InChIKey of N-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine?
The InChIKey is KUHNPPFHUCYMMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-4-17-9-5-6-13(17)11-16(3)14-10-15-8-7-12(14)2/h12-15H,4-11H2,1-3H3.
What are the key properties of N-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine?
N-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine has a molecular weight of 239.41 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine is sourced from PubChem (CID 79313602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).