N-benzyl-N-methylpyrrolidin-3-amine

C12H18N2 — CID 14834678

IUPACN-benzyl-N-methylpyrrolidin-3-amine
SMILESCN(Cc1ccccc1)C1CCNC1
InChIInChI=1S/C12H18N2/c1-14(12-7-8-13-9-12)10-11-5-3-2-4-6-11/h2-6,12-13H,7-10H2,1H3
InChIKeyYYCPQEKHXOHJNG-UHFFFAOYSA-N
MW190.29 g/mol
LogP1.48
Rot. Bonds3

About N-benzyl-N-methylpyrrolidin-3-amine

N-benzyl-N-methylpyrrolidin-3-amine (PubChem CID 14834678) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is N-benzyl-N-methylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-benzyl-N-methylpyrrolidin-3-amine
PubChem CID14834678
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC NameN-benzyl-N-methylpyrrolidin-3-amine
SMILESCN(Cc1ccccc1)C1CCNC1
InChIInChI=1S/C12H18N2/c1-14(12-7-8-13-9-12)10-11-5-3-2-4-6-11/h2-6,12-13H,7-10H2,1H3
InChIKeyYYCPQEKHXOHJNG-UHFFFAOYSA-N
XLogP1.48
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-N-benzyl-N-ethylpyrrolidin-3-amine
CID 66569411
N-benzyl-N-ethylpyrrolidin-3-amine
CID 53410837
N-[(3-bromophenyl)methyl]-N-methylpyrrolidin-3-amine
CID 62327410
(3S)-N-benzyl-N-propan-2-ylpyrrolidin-3-amine
CID 66569418
N-[(3-cyclopropylphenyl)methyl]-N-methylpyrrolidin-3-amine
CID 79984146
N-benzyl-N-propylpyrrolidin-3-amine;hydrochloride
CID 119921759
(3S)-N-benzyl-N-(trifluoromethyl)pyrrolidin-3-amine
CID 71648784
4-[[methyl(pyrrolidin-3-yl)amino]methyl]benzamide
CID 63301451
N-benzyl-N,5-dimethylpiperidin-3-amine
CID 164648058
N-methyl-N-[(4-nitrophenyl)methyl]pyrrolidin-3-amine;hydrochloride
CID 119922933
N-benzyl-N-methyl-1-pyrrolidin-3-ylmethanamine
CID 56831736
N-methyl-N-[(3-nitrophenyl)methyl]pyrrolidin-3-amine;hydrochloride
CID 119922746

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methylpyrrolidin-3-amine?
The IUPAC name of N-benzyl-N-methylpyrrolidin-3-amine (CID 14834678) is N-benzyl-N-methylpyrrolidin-3-amine.
What is the SMILES notation for N-benzyl-N-methylpyrrolidin-3-amine?
The canonical SMILES for N-benzyl-N-methylpyrrolidin-3-amine is CN(Cc1ccccc1)C1CCNC1.
What is the InChIKey of N-benzyl-N-methylpyrrolidin-3-amine?
The InChIKey is YYCPQEKHXOHJNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-14(12-7-8-13-9-12)10-11-5-3-2-4-6-11/h2-6,12-13H,7-10H2,1H3.
What are the key properties of N-benzyl-N-methylpyrrolidin-3-amine?
N-benzyl-N-methylpyrrolidin-3-amine has a molecular weight of 190.29 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methylpyrrolidin-3-amine is sourced from PubChem (CID 14834678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).