N-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine

C16H27N3 — CID 106623353

IUPACN-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine
SMILESCCCN(CC1CCCCN1)C(C)c1ccccn1
InChIInChI=1S/C16H27N3/c1-3-12-19(13-15-8-4-6-10-17-15)14(2)16-9-5-7-11-18-16/h5,7,9,11,14-15,17H,3-4,6,8,10,12-13H2,1-2H3
InChIKeyUQSNKCZWEWCWSM-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.00
Rot. Bonds6

About N-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine

N-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine (PubChem CID 106623353) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is N-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine.

Molecular Properties

Compound NameN-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine
PubChem CID106623353
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC NameN-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine
SMILESCCCN(CC1CCCCN1)C(C)c1ccccn1
InChIInChI=1S/C16H27N3/c1-3-12-19(13-15-8-4-6-10-17-15)14(2)16-9-5-7-11-18-16/h5,7,9,11,14-15,17H,3-4,6,8,10,12-13H2,1-2H3
InChIKeyUQSNKCZWEWCWSM-UHFFFAOYSA-N
XLogP3.00
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(5-fluoro-2-pyridinyl)ethyl]-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106603963
N-[1-(2-fluorophenyl)ethyl]-N-(piperidin-2-ylmethyl)propan-1-amine
CID 106623204
N-[1-(2-bromophenyl)ethyl]-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106603813
N-[1-(5-methylthiophen-2-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-1-amine
CID 106623202
N-(1-pyrazin-2-ylethyl)-N-(pyrrolidin-2-ylmethyl)butan-1-amine
CID 106604977
N-[1-(3,5-difluorophenyl)ethyl]-N-(piperidin-2-ylmethyl)propan-1-amine
CID 106623383
N-[1-(5-bromothiophen-2-yl)ethyl]-N-(piperidin-2-ylmethyl)propan-1-amine
CID 106623215
2-(1-pyrrolidin-2-ylpropan-2-yl)pyridine
CID 83907313
4-methyl-2-[1-[piperidin-2-ylmethyl(propyl)amino]ethyl]phenol
CID 106623363
2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine
CID 97162432
1-piperidin-2-yl-N-[(1R)-1-pyridin-2-ylethyl]propan-2-amine
CID 81401502
1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine
CID 81402179

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine?
The IUPAC name of N-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine (CID 106623353) is N-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine.
What is the SMILES notation for N-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine?
The canonical SMILES for N-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine is CCCN(CC1CCCCN1)C(C)c1ccccn1.
What is the InChIKey of N-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine?
The InChIKey is UQSNKCZWEWCWSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-3-12-19(13-15-8-4-6-10-17-15)14(2)16-9-5-7-11-18-16/h5,7,9,11,14-15,17H,3-4,6,8,10,12-13H2,1-2H3.
What are the key properties of N-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine?
N-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine has a molecular weight of 261.41 g/mol, XLogP of 3.00, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine is sourced from PubChem (CID 106623353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).