N-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine

C15H24N2 — CID 103626279

IUPACN-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine
SMILESCC(CNCC1CCCN1C)c1ccccc1
InChIInChI=1S/C15H24N2/c1-13(14-7-4-3-5-8-14)11-16-12-15-9-6-10-17(15)2/h3-5,7-8,13,15-16H,6,9-12H2,1-2H3
InChIKeyBJWDXUONEQPGCF-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.47
Rot. Bonds5

About N-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine

N-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine (PubChem CID 103626279) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine.

Molecular Properties

Compound NameN-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine
PubChem CID103626279
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine
SMILESCC(CNCC1CCCN1C)c1ccccc1
InChIInChI=1S/C15H24N2/c1-13(14-7-4-3-5-8-14)11-16-12-15-9-6-10-17(15)2/h3-5,7-8,13,15-16H,6,9-12H2,1-2H3
InChIKeyBJWDXUONEQPGCF-UHFFFAOYSA-N
XLogP2.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1-methylpyrrolidin-2-yl)methyl]-3-phenylbutan-1-amine
CID 107094689
1-[(1-methylpyrrolidin-2-yl)methylamino]-3-(1-phenylethoxy)propan-2-ol
CID 106025545
1-(3-methoxyphenyl)-2-[(1-methylpyrrolidin-2-yl)methylamino]ethanol
CID 106025460
2-phenyl-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106636659
[[(1R,2R)-2-[[(2S)-1-methylpyrrolidin-2-yl]methylamino]-1,2-diphenylethyl]amino] thiohypoiodite
CID 167221164
(2R)-2-phenyl-N-[(2S)-2-phenylpropyl]propan-1-amine
CID 7054159
(2R)-N-[[(2S)-oxolan-2-yl]methyl]-2-phenylpropan-1-amine
CID 40654008
N-(oxolan-2-ylmethyl)-2-phenylpropan-1-amine
CID 3366630
N-[(1,4-dimethylpiperazin-2-yl)methyl]-3-phenylbutan-1-amine
CID 63896874
2,2-dimethoxy-N-[(1-methylpyrrolidin-2-yl)methyl]ethanamine
CID 106024028
2,3-dimethyl-N-[(1-methylpiperidin-2-yl)methyl]butan-1-amine
CID 64570270
N-[[4-(2-methylpropyl)phenyl]methyl]-1-(1-methylpyrrolidin-2-yl)methanamine
CID 103748214

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine?
The IUPAC name of N-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine (CID 103626279) is N-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine.
What is the SMILES notation for N-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine?
The canonical SMILES for N-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine is CC(CNCC1CCCN1C)c1ccccc1.
What is the InChIKey of N-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine?
The InChIKey is BJWDXUONEQPGCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-13(14-7-4-3-5-8-14)11-16-12-15-9-6-10-17(15)2/h3-5,7-8,13,15-16H,6,9-12H2,1-2H3.
What are the key properties of N-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine?
N-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylpyrrolidin-2-yl)methyl]-2-phenylpropan-1-amine is sourced from PubChem (CID 103626279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).