N-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine

C17H21N3 — CID 130165925

IUPACN-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine
SMILESCc1cccnc1NC1CCN(Cc2ccccc2)C1
InChIInChI=1S/C17H21N3/c1-14-6-5-10-18-17(14)19-16-9-11-20(13-16)12-15-7-3-2-4-8-15/h2-8,10,16H,9,11-13H2,1H3,(H,18,19)
InChIKeyZHJKHBJMHDZPDT-UHFFFAOYSA-N
MW267.38 g/mol
LogP3.08
Rot. Bonds4

About N-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine

N-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine (PubChem CID 130165925) has the molecular formula C17H21N3 and a molecular weight of 267.38 g/mol. Its IUPAC name is N-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine.

Molecular Properties

Compound NameN-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine
PubChem CID130165925
Molecular FormulaC17H21N3
Molecular Weight267.38 g/mol
Exact Mass267.17
IUPAC NameN-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine
SMILESCc1cccnc1NC1CCN(Cc2ccccc2)C1
InChIInChI=1S/C17H21N3/c1-14-6-5-10-18-17(14)19-16-9-11-20(13-16)12-15-7-3-2-4-8-15/h2-8,10,16H,9,11-13H2,1H3,(H,18,19)
InChIKeyZHJKHBJMHDZPDT-UHFFFAOYSA-N
XLogP3.08
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.38
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-benzylpiperidin-3-yl)-2-methylpyridin-3-amine
CID 79042917
4-[3-[[(3R)-1-benzylpyrrolidin-3-yl]amino]pyrazin-2-yl]phenol
CID 137154175
3-[(1-benzylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile
CID 130167064
1-benzyl-N-(3,5-dimethylphenyl)pyrrolidin-3-amine
CID 43150672
N-[(3R)-1-benzylpyrrolidin-3-yl]-5-ethylpyrimidin-2-amine
CID 97203878
1-benzyl-N-(2,6-dichlorophenyl)pyrrolidin-3-amine
CID 65469717
2-N-(1-benzylpyrrolidin-3-yl)-3-chloropyridine-2,5-diamine
CID 130558164
ethyl (E)-3-[6-[[(3R)-1-benzylpyrrolidin-3-yl]amino]-5-methyl-3-pyridinyl]prop-2-enoate
CID 86603664
4-N-(1-benzylpyrrolidin-3-yl)-2-methylpyrimidine-4,6-diamine
CID 130559123
1-benzyl-N-[1-(3-methyl-2-pyridinyl)propyl]piperidin-4-amine
CID 50979377
1-benzyl-N-pentan-3-ylpyrrolidin-3-amine
CID 43150638
N-(1-benzylpyrrolidin-3-yl)-1-ethylpyrazol-4-amine
CID 43543283

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine?
The IUPAC name of N-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine (CID 130165925) is N-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine.
What is the SMILES notation for N-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine?
The canonical SMILES for N-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine is Cc1cccnc1NC1CCN(Cc2ccccc2)C1.
What is the InChIKey of N-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine?
The InChIKey is ZHJKHBJMHDZPDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3/c1-14-6-5-10-18-17(14)19-16-9-11-20(13-16)12-15-7-3-2-4-8-15/h2-8,10,16H,9,11-13H2,1H3,(H,18,19).
What are the key properties of N-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine?
N-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine has a molecular weight of 267.38 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpyrrolidin-3-yl)-3-methylpyridin-2-amine is sourced from PubChem (CID 130165925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).