N-(cyclopentylmethyl)-N-methyl-1-phenylethanamine

C15H23N — CID 78880741

IUPACN-(cyclopentylmethyl)-N-methyl-1-phenylethanamine
SMILESCC(c1ccccc1)N(C)CC1CCCC1
InChIInChI=1S/C15H23N/c1-13(15-10-4-3-5-11-15)16(2)12-14-8-6-7-9-14/h3-5,10-11,13-14H,6-9,12H2,1-2H3
InChIKeyLZKZXXILEUGFKK-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.87
Rot. Bonds4

About N-(cyclopentylmethyl)-N-methyl-1-phenylethanamine

N-(cyclopentylmethyl)-N-methyl-1-phenylethanamine (PubChem CID 78880741) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-N-methyl-1-phenylethanamine.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-N-methyl-1-phenylethanamine
PubChem CID78880741
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC NameN-(cyclopentylmethyl)-N-methyl-1-phenylethanamine
SMILESCC(c1ccccc1)N(C)CC1CCCC1
InChIInChI=1S/C15H23N/c1-13(15-10-4-3-5-11-15)16(2)12-14-8-6-7-9-14/h3-5,10-11,13-14H,6-9,12H2,1-2H3
InChIKeyLZKZXXILEUGFKK-UHFFFAOYSA-N
XLogP3.87
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-[1-[cyclohexylmethyl(methyl)amino]ethyl]aniline
CID 61443836
3-[1-[cyclopentylmethyl(methyl)amino]ethyl]aniline
CID 63632090
2-[1-[cyclopentylmethyl(methyl)amino]ethyl]phenol
CID 82721244
N-methyl-1-phenyl-N-(pyrrolidin-3-ylmethyl)ethanamine
CID 23292007
3-[cyclobutylmethyl(methyl)amino]-3-phenylpropan-1-ol
CID 111489141
2-[cyclohexylmethyl(methyl)amino]-2-phenylacetic acid
CID 61446245
N-(cyclopentylmethyl)-N'-ethyl-N-methyl-1-phenylethane-1,2-diamine
CID 63655923
N'-(cyclopropylmethyl)-N'-methyl-1-phenylmethanediamine
CID 156529425
N-methyl-N-[(1R)-1-phenylethyl]cyclohexanamine
CID 68742462
N'-(cyclopentylmethyl)-N'-methyl-1-phenylbutane-1,4-diamine
CID 63656962
(1S)-N,N-dimethyl-1-phenylethanamine
CID 2724276
4-[1-[methyl(oxan-3-ylmethyl)amino]ethyl]aniline
CID 63726580

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-N-methyl-1-phenylethanamine?
The IUPAC name of N-(cyclopentylmethyl)-N-methyl-1-phenylethanamine (CID 78880741) is N-(cyclopentylmethyl)-N-methyl-1-phenylethanamine.
What is the SMILES notation for N-(cyclopentylmethyl)-N-methyl-1-phenylethanamine?
The canonical SMILES for N-(cyclopentylmethyl)-N-methyl-1-phenylethanamine is CC(c1ccccc1)N(C)CC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-N-methyl-1-phenylethanamine?
The InChIKey is LZKZXXILEUGFKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-13(15-10-4-3-5-11-15)16(2)12-14-8-6-7-9-14/h3-5,10-11,13-14H,6-9,12H2,1-2H3.
What are the key properties of N-(cyclopentylmethyl)-N-methyl-1-phenylethanamine?
N-(cyclopentylmethyl)-N-methyl-1-phenylethanamine has a molecular weight of 217.36 g/mol, XLogP of 3.87, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-N-methyl-1-phenylethanamine is sourced from PubChem (CID 78880741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).