(3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine

C20H27N3 — CID 51635983

IUPAC(3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine
SMILESCc1cccc(CN2CCC[C@@H](N(C)Cc3ccccc3)C2)n1
InChIInChI=1S/C20H27N3/c1-17-8-6-11-19(21-17)15-23-13-7-12-20(16-23)22(2)14-18-9-4-3-5-10-18/h3-6,8-11,20H,7,12-16H2,1-2H3/t20-/m1/s1
InChIKeyIUDICURRQBTOTJ-HXUWFJFHSA-N
MW309.46 g/mol
LogP3.49
Rot. Bonds5

About (3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine

(3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine (PubChem CID 51635983) has the molecular formula C20H27N3 and a molecular weight of 309.46 g/mol. Its IUPAC name is (3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine.

Molecular Properties

Compound Name(3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine
PubChem CID51635983
Molecular FormulaC20H27N3
Molecular Weight309.46 g/mol
Exact Mass309.22
IUPAC Name(3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine
SMILESCc1cccc(CN2CCC[C@@H](N(C)Cc3ccccc3)C2)n1
InChIInChI=1S/C20H27N3/c1-17-8-6-11-19(21-17)15-23-13-7-12-20(16-23)22(2)14-18-9-4-3-5-10-18/h3-6,8-11,20H,7,12-16H2,1-2H3/t20-/m1/s1
InChIKeyIUDICURRQBTOTJ-HXUWFJFHSA-N
XLogP3.49
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.46
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-benzylpiperidin-3-yl)-N,6-dimethylpyridin-2-amine
CID 133483749
1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine
CID 11160034
(6S)-1-benzyl-4-[(6-methyl-2-pyridinyl)methyl]-1,4-diazepan-6-ol
CID 97285618
6-[[3-(dimethylamino)piperidin-1-yl]methyl]pyridin-2-amine
CID 79230714
N-benzyl-N,1-dimethylpiperidin-3-amine;ethane
CID 142272680
N-methyl-N-[1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine
CID 172903124
N-[[1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-yl]methyl]ethanamine
CID 79267719
N-benzyl-1-[(2-butyl-1H-imidazol-5-yl)methyl]-N-methylpiperidin-3-amine
CID 45228125
3-methyl-1-[(6-methyl-2-pyridinyl)methyl]-1,4-diazepane
CID 64948769
2-methyl-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine
CID 74234895
6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine
CID 79234659
1-[(6-methyl-2-pyridinyl)methyl]piperidine-3,4-dicarboxylic acid
CID 115918772

Frequently Asked Questions

What is the IUPAC name of (3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine?
The IUPAC name of (3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine (CID 51635983) is (3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine.
What is the SMILES notation for (3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine?
The canonical SMILES for (3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine is Cc1cccc(CN2CCC[C@@H](N(C)Cc3ccccc3)C2)n1.
What is the InChIKey of (3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine?
The InChIKey is IUDICURRQBTOTJ-HXUWFJFHSA-N. The full InChI is InChI=1S/C20H27N3/c1-17-8-6-11-19(21-17)15-23-13-7-12-20(16-23)22(2)14-18-9-4-3-5-10-18/h3-6,8-11,20H,7,12-16H2,1-2H3/t20-/m1/s1.
What are the key properties of (3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine?
(3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine has a molecular weight of 309.46 g/mol, XLogP of 3.49, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-benzyl-N-methyl-1-[(6-methyl-2-pyridinyl)methyl]piperidin-3-amine is sourced from PubChem (CID 51635983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).