1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine

C15H25N3 — CID 81402179

IUPAC1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine
SMILESCC(CC1CCCCN1)N[C@@H](C)c1ccccn1
InChIInChI=1S/C15H25N3/c1-12(11-14-7-3-5-9-16-14)18-13(2)15-8-4-6-10-17-15/h4,6,8,10,12-14,16,18H,3,5,7,9,11H2,1-2H3/t12?,13-,14?/m0/s1
InChIKeyFGDUVQUZIJVULL-MOKVOYLWSA-N
MW247.39 g/mol
LogP2.65
Rot. Bonds5

About 1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine

1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine (PubChem CID 81402179) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine.

Molecular Properties

Compound Name1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine
PubChem CID81402179
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine
SMILESCC(CC1CCCCN1)N[C@@H](C)c1ccccn1
InChIInChI=1S/C15H25N3/c1-12(11-14-7-3-5-9-16-14)18-13(2)15-8-4-6-10-17-15/h4,6,8,10,12-14,16,18H,3,5,7,9,11H2,1-2H3/t12?,13-,14?/m0/s1
InChIKeyFGDUVQUZIJVULL-MOKVOYLWSA-N
XLogP2.65
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-piperidin-2-yl-N-[(1R)-1-pyridin-2-ylethyl]propan-2-amine
CID 81401502
2-(1-pyrrolidin-2-ylpropan-2-yl)pyridine
CID 83907313
1-piperidin-2-yl-N-[(1R)-1-pyridin-4-ylethyl]propan-2-amine
CID 81405627
1-(azepan-2-yl)-N-[(1R)-1-(2-methylphenyl)ethyl]propan-2-amine
CID 81373374
1-(azepan-2-yl)-N-[1-(2-methylphenyl)ethyl]propan-2-amine
CID 79553763
1-(azepan-2-yl)-N-[(1R)-1-(2-fluorophenyl)ethyl]propan-2-amine
CID 81379842
(1S)-N-[[(2S)-piperidin-2-yl]methyl]-1-pyridin-2-ylethanesulfonamide
CID 97162061
N-[1-(furan-2-yl)ethyl]-1-piperidin-2-ylpropan-2-amine
CID 79549697
N-[(1S)-1-(4-fluorophenyl)ethyl]-1-piperidin-2-ylpropan-2-amine
CID 81348101
1-(azepan-2-yl)-N-[1-(furan-2-yl)ethyl]propan-2-amine
CID 79560545
1-(azepan-2-yl)-N-[1-(4-methylphenyl)ethyl]propan-2-amine
CID 79560959
(2S)-N-(1-pyridin-2-ylethyl)piperidine-2-carboxamide
CID 103813258

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine?
The IUPAC name of 1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine (CID 81402179) is 1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine.
What is the SMILES notation for 1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine?
The canonical SMILES for 1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine is CC(CC1CCCCN1)N[C@@H](C)c1ccccn1.
What is the InChIKey of 1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine?
The InChIKey is FGDUVQUZIJVULL-MOKVOYLWSA-N. The full InChI is InChI=1S/C15H25N3/c1-12(11-14-7-3-5-9-16-14)18-13(2)15-8-4-6-10-17-15/h4,6,8,10,12-14,16,18H,3,5,7,9,11H2,1-2H3/t12?,13-,14?/m0/s1.
What are the key properties of 1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine?
1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine has a molecular weight of 247.39 g/mol, XLogP of 2.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine is sourced from PubChem (CID 81402179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).