1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine

C15H24N2 — CID 113285206

IUPAC1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine
SMILESCCc1ccccc1CN1CCCC1CNC
InChIInChI=1S/C15H24N2/c1-3-13-7-4-5-8-14(13)12-17-10-6-9-15(17)11-16-2/h4-5,7-8,15-16H,3,6,9-12H2,1-2H3
InChIKeyAWMHDBDLKOHDGP-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.43
Rot. Bonds5

About 1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine

1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine (PubChem CID 113285206) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine
PubChem CID113285206
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine
SMILESCCc1ccccc1CN1CCCC1CNC
InChIInChI=1S/C15H24N2/c1-3-13-7-4-5-8-14(13)12-17-10-6-9-15(17)11-16-2/h4-5,7-8,15-16H,3,6,9-12H2,1-2H3
InChIKeyAWMHDBDLKOHDGP-UHFFFAOYSA-N
XLogP2.43
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 ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-[[2-(methylaminomethyl)pyrrolidin-1-yl]methyl]phenyl]acetic acid
CID 115463132
1-[1-[(2-chlorophenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine;hydrochloride
CID 119928352
1-[1-[(2-ethyl-4-methoxyphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine
CID 120842813
1-[1-[(2,3-dimethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine
CID 113285201
N-methyl-1-[1-[[2-(trifluoromethyl)phenyl]methyl]piperidin-2-yl]methanamine
CID 63249109
1-[1-[[2-(difluoromethoxy)phenyl]methyl]pyrrolidin-2-yl]-N-methylmethanamine;hydrochloride
CID 119928550
1-(1-ethylpyrrolidin-2-yl)-N-methylmethanamine;2-methylbenzaldehyde
CID 143796965
1-[1-[(4-fluoro-2-methylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine
CID 115316184
1-[1-(2-ethylphenyl)sulfonylpyrrolidin-2-yl]-N-methylmethanamine
CID 120712080
1-[1-[(2-methoxy-5-methylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine;hydrochloride
CID 119928465
N-[[1-[(2-methylphenyl)methyl]pyrrolidin-2-yl]methyl]propan-2-amine
CID 62580367
4-methyl-2-[[2-(methylaminomethyl)piperidin-1-yl]methyl]phenol
CID 63325311

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine (CID 113285206) is 1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine is CCc1ccccc1CN1CCCC1CNC.
What is the InChIKey of 1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine?
The InChIKey is AWMHDBDLKOHDGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-3-13-7-4-5-8-14(13)12-17-10-6-9-15(17)11-16-2/h4-5,7-8,15-16H,3,6,9-12H2,1-2H3.
What are the key properties of 1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine?
1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine has a molecular weight of 232.37 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(2-ethylphenyl)methyl]pyrrolidin-2-yl]-N-methylmethanamine is sourced from PubChem (CID 113285206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).