(3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine

C16H20N4O — CID 124623272

IUPAC(3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine
SMILESCOc1cccc(CN[C@H]2CCN(c3ccccn3)C2)n1
InChIInChI=1S/C16H20N4O/c1-21-16-7-4-5-13(19-16)11-18-14-8-10-20(12-14)15-6-2-3-9-17-15/h2-7,9,14,18H,8,10-12H2,1H3/t14-/m0/s1
InChIKeyDYKBHKYBQNKDQX-AWEZNQCLSA-N
MW284.36 g/mol
LogP1.85
Rot. Bonds5

About (3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine

(3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine (PubChem CID 124623272) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is (3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine.

Molecular Properties

Compound Name(3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine
PubChem CID124623272
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name(3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine
SMILESCOc1cccc(CN[C@H]2CCN(c3ccccn3)C2)n1
InChIInChI=1S/C16H20N4O/c1-21-16-7-4-5-13(19-16)11-18-14-8-10-20(12-14)15-6-2-3-9-17-15/h2-7,9,14,18H,8,10-12H2,1H3/t14-/m0/s1
InChIKeyDYKBHKYBQNKDQX-AWEZNQCLSA-N
XLogP1.85
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-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-[(6-bromo-2-pyridinyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 115937851
1-cyclopropyl-N-[(6-methoxy-2-pyridinyl)methyl]pyrrolidin-3-amine
CID 63986474
(3R)-N-methyl-1-pyridin-2-ylpyrrolidin-3-amine
CID 141191344
N-methyl-1-pyridin-2-ylpyrrolidin-3-amine
CID 79002061
4-methoxy-N-(1-pyridin-2-ylpyrrolidin-3-yl)benzenesulfonamide
CID 90621518
N-[(2-morpholin-4-ylphenyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine
CID 75446101
1-(6-methoxy-2-pyridinyl)-N-propylpiperidin-4-amine
CID 63588941
1-(6-methoxy-2-pyridinyl)-N-methylpiperidin-4-amine
CID 63591617
N-[(4-ethylphenyl)methyl]-1-pyridin-2-ylpiperidin-4-amine
CID 119126767
N-(3-methoxy-3-methylbutyl)-1-pyridin-2-ylpiperidin-4-amine
CID 106675135
1-pyridin-2-yl-N-(2-pyridin-2-ylethyl)piperidin-4-amine
CID 43761318
ethane;1-methyl-3-(1-pyridin-2-ylpyrrolidin-3-yl)urea
CID 91102074

Frequently Asked Questions

What is the IUPAC name of (3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine?
The IUPAC name of (3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine (CID 124623272) is (3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine.
What is the SMILES notation for (3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine?
The canonical SMILES for (3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine is COc1cccc(CN[C@H]2CCN(c3ccccn3)C2)n1.
What is the InChIKey of (3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine?
The InChIKey is DYKBHKYBQNKDQX-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H20N4O/c1-21-16-7-4-5-13(19-16)11-18-14-8-10-20(12-14)15-6-2-3-9-17-15/h2-7,9,14,18H,8,10-12H2,1H3/t14-/m0/s1.
What are the key properties of (3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine?
(3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine has a molecular weight of 284.36 g/mol, XLogP of 1.85, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-[(6-methoxy-2-pyridinyl)methyl]-1-pyridin-2-ylpyrrolidin-3-amine is sourced from PubChem (CID 124623272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).