N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine

C15H23N — CID 60818890

IUPACN-[cyclopentyl-(3-methylphenyl)methyl]ethanamine
SMILESCCNC(c1cccc(C)c1)C1CCCC1
InChIInChI=1S/C15H23N/c1-3-16-15(13-8-4-5-9-13)14-10-6-7-12(2)11-14/h6-7,10-11,13,15-16H,3-5,8-9H2,1-2H3
InChIKeyOMMSLRRZEOYZMJ-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.84
Rot. Bonds4

About N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine

N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine (PubChem CID 60818890) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[cyclopentyl-(3-methylphenyl)methyl]ethanamine
PubChem CID60818890
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC NameN-[cyclopentyl-(3-methylphenyl)methyl]ethanamine
SMILESCCNC(c1cccc(C)c1)C1CCCC1
InChIInChI=1S/C15H23N/c1-3-16-15(13-8-4-5-9-13)14-10-6-7-12(2)11-14/h6-7,10-11,13,15-16H,3-5,8-9H2,1-2H3
InChIKeyOMMSLRRZEOYZMJ-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[cycloheptyl-(3-methylphenyl)methyl]ethanamine
CID 65399254
N-[(4-ethylcyclohexyl)-(3-methylphenyl)methyl]ethanamine
CID 64774201
N-[7-bicyclo[4.1.0]heptanyl-(3-methylphenyl)methyl]ethanamine
CID 115789774
N-[(3-methylphenyl)-(oxan-3-yl)methyl]ethanamine
CID 65331704
N-[cycloheptyl-(3-iodophenyl)methyl]ethanamine
CID 105027846
1-cycloheptyl-N-methyl-1-(3-methylphenyl)methanamine
CID 65399402
1-cyclohexyl-N-methyl-1-(3-methylphenyl)methanamine
CID 60818000
N-[cyclooctyl-(3-propylphenyl)methyl]ethanamine
CID 116544896
N-[cycloheptyl-(3-propylphenyl)methyl]ethanamine
CID 116544538
N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine
CID 60797775
N-[cyclobutyl(phenyl)methyl]ethanamine
CID 43489136
N-[cyclopentyl-(3-fluoro-5-methylphenyl)methyl]ethanamine
CID 79704680

Frequently Asked Questions

What is the IUPAC name of N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine?
The IUPAC name of N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine (CID 60818890) is N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine.
What is the SMILES notation for N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine?
The canonical SMILES for N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine is CCNC(c1cccc(C)c1)C1CCCC1.
What is the InChIKey of N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine?
The InChIKey is OMMSLRRZEOYZMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-3-16-15(13-8-4-5-9-13)14-10-6-7-12(2)11-14/h6-7,10-11,13,15-16H,3-5,8-9H2,1-2H3.
What are the key properties of N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine?
N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine has a molecular weight of 217.36 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopentyl-(3-methylphenyl)methyl]ethanamine is sourced from PubChem (CID 60818890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).