N-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine

C15H22N2 — CID 115328538

IUPACN-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine
SMILESC=C(CN1CCCC1CNC)c1ccccc1
InChIInChI=1S/C15H22N2/c1-13(14-7-4-3-5-8-14)12-17-10-6-9-15(17)11-16-2/h3-5,7-8,15-16H,1,6,9-12H2,2H3
InChIKeySRGKRLZEGIFIMC-UHFFFAOYSA-N
MW230.36 g/mol
LogP2.38
Rot. Bonds5

About N-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine

N-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine (PubChem CID 115328538) has the molecular formula C15H22N2 and a molecular weight of 230.36 g/mol. Its IUPAC name is N-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine
PubChem CID115328538
Molecular FormulaC15H22N2
Molecular Weight230.36 g/mol
Exact Mass230.18
IUPAC NameN-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine
SMILESC=C(CN1CCCC1CNC)c1ccccc1
InChIInChI=1S/C15H22N2/c1-13(14-7-4-3-5-8-14)12-17-10-6-9-15(17)11-16-2/h3-5,7-8,15-16H,1,6,9-12H2,2H3
InChIKeySRGKRLZEGIFIMC-UHFFFAOYSA-N
XLogP2.38
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.36
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-phenylpropan-2-ol
CID 113285351
2-[2-[[2-(methylaminomethyl)pyrrolidin-1-yl]methyl]phenyl]acetic acid
CID 115463132
N-benzyl-2-[2-(methylaminomethyl)piperidin-1-yl]acetamide
CID 63249994
N-methyl-1-[1-(2-methylidenebutyl)piperidin-2-yl]methanamine
CID 66044070
1-[1-(2,2-difluoro-2-phenylethyl)piperidin-2-yl]-N-methylmethanamine
CID 116789649
N-(2-fluorophenyl)-2-[2-(methylaminomethyl)pyrrolidin-1-yl]acetamide
CID 81490988
1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine
CID 113285206
2-[2-(methylaminomethyl)piperidin-1-yl]-N-(1-phenylethyl)acetamide
CID 63250347
N-(2-fluorophenyl)-2-[2-(methylaminomethyl)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119928583
2-[2-(methylaminomethyl)piperidin-1-yl]-1-phenylethanol
CID 55169694
N-methyl-1-[1-(2-phenoxyethyl)pyrrolidin-2-yl]methanamine;hydrochloride
CID 119928558
N-(2-methoxyphenyl)-2-[2-(methylaminomethyl)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119928580

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine?
The IUPAC name of N-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine (CID 115328538) is N-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine.
What is the SMILES notation for N-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine?
The canonical SMILES for N-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine is C=C(CN1CCCC1CNC)c1ccccc1.
What is the InChIKey of N-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine?
The InChIKey is SRGKRLZEGIFIMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-13(14-7-4-3-5-8-14)12-17-10-6-9-15(17)11-16-2/h3-5,7-8,15-16H,1,6,9-12H2,2H3.
What are the key properties of N-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine?
N-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine has a molecular weight of 230.36 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[1-(2-phenylprop-2-enyl)pyrrolidin-2-yl]methanamine is sourced from PubChem (CID 115328538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).