1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine

C14H29N3 — CID 63143290

IUPAC1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine
SMILESCCN1CCC(N(C)CC2(C)CCNC2)CC1
InChIInChI=1S/C14H29N3/c1-4-17-9-5-13(6-10-17)16(3)12-14(2)7-8-15-11-14/h13,15H,4-12H2,1-3H3
InChIKeyITHIJOSEVNXXHH-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.40
Rot. Bonds4

About 1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine

1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine (PubChem CID 63143290) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is 1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine.

Molecular Properties

Compound Name1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine
PubChem CID63143290
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC Name1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine
SMILESCCN1CCC(N(C)CC2(C)CCNC2)CC1
InChIInChI=1S/C14H29N3/c1-4-17-9-5-13(6-10-17)16(3)12-14(2)7-8-15-11-14/h13,15H,4-12H2,1-3H3
InChIKeyITHIJOSEVNXXHH-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

4-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]cyclohexan-1-amine;hydrochloride
CID 120898331
1-[[(1-ethylpiperidin-4-yl)-methylamino]methyl]cyclopentan-1-ol
CID 65212623
N,3-dimethyl-N-[(3-methylpyrrolidin-3-yl)methyl]cyclohexan-1-amine;hydrochloride
CID 120898335
N,N-diethyl-1-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidin-3-amine
CID 63536783
1-(4-ethylpiperazin-1-yl)-2-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]ethanone
CID 120900089
N-[[1-(bromomethyl)cyclohexyl]methyl]-1-ethyl-N-methylpiperidin-4-amine
CID 65002528
1-benzyl-N-ethyl-N-[(3-methylpyrrolidin-3-yl)methyl]pyrrolidin-3-amine;hydrochloride
CID 120902348
8-ethyl-2,8-diazaspiro[4.5]decane
CID 46318290
N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]propan-1-amine
CID 63143016
N-ethyl-N-[1-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-yl]methanesulfonamide;hydrochloride
CID 120903287
4-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]piperidin-4-ol
CID 55048858
1-ethyl-N-methyl-N-(pyrrolidin-3-ylmethyl)piperidin-4-amine
CID 62370363

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine?
The IUPAC name of 1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine (CID 63143290) is 1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine.
What is the SMILES notation for 1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine?
The canonical SMILES for 1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine is CCN1CCC(N(C)CC2(C)CCNC2)CC1.
What is the InChIKey of 1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine?
The InChIKey is ITHIJOSEVNXXHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-4-17-9-5-13(6-10-17)16(3)12-14(2)7-8-15-11-14/h13,15H,4-12H2,1-3H3.
What are the key properties of 1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine?
1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-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 1-ethyl-N-methyl-N-[(3-methylpyrrolidin-3-yl)methyl]piperidin-4-amine is sourced from PubChem (CID 63143290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).