N-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine

C18H23N3 — CID 130893109

IUPACN-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine
SMILESCC1CN(Cc2ccccc2)CCC1Nc1ccccn1
InChIInChI=1S/C18H23N3/c1-15-13-21(14-16-7-3-2-4-8-16)12-10-17(15)20-18-9-5-6-11-19-18/h2-9,11,15,17H,10,12-14H2,1H3,(H,19,20)
InChIKeyRIJHTPLWXQVQOA-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.40
Rot. Bonds4

About N-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine

N-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine (PubChem CID 130893109) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine
PubChem CID130893109
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC NameN-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine
SMILESCC1CN(Cc2ccccc2)CCC1Nc1ccccn1
InChIInChI=1S/C18H23N3/c1-15-13-21(14-16-7-3-2-4-8-16)12-10-17(15)20-18-9-5-6-11-19-18/h2-9,11,15,17H,10,12-14H2,1H3,(H,19,20)
InChIKeyRIJHTPLWXQVQOA-UHFFFAOYSA-N
XLogP3.40
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-benzyl-3-methylpiperidin-4-yl)-2-chloropyrimidin-4-amine
CID 130891534
N-[(3S,4S)-1-(3-ethoxypropyl)-3-methylpiperidin-4-yl]pyridin-2-amine
CID 100857566
N-[(3R,4S)-1-(3-ethoxypropyl)-3-methylpiperidin-4-yl]pyridin-2-amine
CID 97029599
2-N-(1-benzyl-3-methylpiperidin-4-yl)-1,3-thiazole-2,5-diamine
CID 130855413
N-(1-benzyl-3-methylpiperidin-4-yl)furan-2-carboxamide
CID 136512736
N-[3-[[(3R,4S)-1-benzyl-3-methylpiperidin-4-yl]amino]phenyl]acetamide
CID 68964157
6-ethoxy-N-[(3R,4S)-3-methyl-1-(pyridin-2-ylmethyl)piperidin-4-yl]pyrimidin-4-amine
CID 124735936
N-(2-methylcyclohexyl)pyridin-2-amine
CID 43079705
[(3S,4S)-1-benzyl-4-methylpiperidin-3-yl]carbamic acid
CID 137369868
tert-butyl N-[(3R,4R)-1-benzyl-3-methylpiperidin-4-yl]carbamate
CID 69019941
(3S,4S)-1-benzyl-4-chloro-3-methylpiperidine
CID 97176910
N-[(3S,4R)-1-benzyl-3-methylpiperidin-4-yl]-3-methoxypropanamide
CID 98773554

Frequently Asked Questions

What is the IUPAC name of N-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine?
The IUPAC name of N-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine (CID 130893109) is N-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine.
What is the SMILES notation for N-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine?
The canonical SMILES for N-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine is CC1CN(Cc2ccccc2)CCC1Nc1ccccn1.
What is the InChIKey of N-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine?
The InChIKey is RIJHTPLWXQVQOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-15-13-21(14-16-7-3-2-4-8-16)12-10-17(15)20-18-9-5-6-11-19-18/h2-9,11,15,17H,10,12-14H2,1H3,(H,19,20).
What are the key properties of N-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine?
N-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine has a molecular weight of 281.40 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzyl-3-methylpiperidin-4-yl)pyridin-2-amine is sourced from PubChem (CID 130893109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).