N'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine

C15H24N2 — CID 114547321

IUPACN'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine
SMILESCC1CCC(NCCC(N)c2ccccc2)C1
InChIInChI=1S/C15H24N2/c1-12-7-8-14(11-12)17-10-9-15(16)13-5-3-2-4-6-13/h2-6,12,14-15,17H,7-11,16H2,1H3
InChIKeyDRULSJPDNXLEGN-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.85
Rot. Bonds5

About N'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine

N'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine (PubChem CID 114547321) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine
PubChem CID114547321
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine
SMILESCC1CCC(NCCC(N)c2ccccc2)C1
InChIInChI=1S/C15H24N2/c1-12-7-8-14(11-12)17-10-9-15(16)13-5-3-2-4-6-13/h2-6,12,14-15,17H,7-11,16H2,1H3
InChIKeyDRULSJPDNXLEGN-UHFFFAOYSA-N
XLogP2.85
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-N-(3,3-diphenylpropyl)-3-methylcyclopentan-1-amine
CID 71032236
N'-(3-methylcyclopentyl)-1-phenylethane-1,2-diamine
CID 114547176
1-N-(3-methylcyclopentyl)hexane-1,3-diamine
CID 114547292
N'-cyclopentyl-1-phenylbutane-1,4-diamine
CID 63321714
(2R)-4-[[(1S,3S)-3-methylcyclopentyl]amino]butan-2-ol
CID 96784285
(2S)-4-[[(1S,3R)-3-methylcyclopentyl]amino]butan-2-ol
CID 124674906
N-(3-phenylbutyl)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
CID 63463227
N-[cyclopropyl(phenyl)methyl]-3-methylcyclopentan-1-amine
CID 64500445
2-[[(3-methylcyclopentyl)amino]methyl]aniline
CID 114543904
3-methyl-N-[(4-phenylphenyl)methyl]cyclopentan-1-amine
CID 114543884
1-N-(3-phenylbutyl)cyclobutane-1,3-diamine
CID 80562292
N-(3,3-dimethyl-1-phenylbutyl)-3-methylcyclopentan-1-amine
CID 64502336

Frequently Asked Questions

What is the IUPAC name of N'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine?
The IUPAC name of N'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine (CID 114547321) is N'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine.
What is the SMILES notation for N'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine?
The canonical SMILES for N'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine is CC1CCC(NCCC(N)c2ccccc2)C1.
What is the InChIKey of N'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine?
The InChIKey is DRULSJPDNXLEGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12-7-8-14(11-12)17-10-9-15(16)13-5-3-2-4-6-13/h2-6,12,14-15,17H,7-11,16H2,1H3.
What are the key properties of N'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine?
N'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine has a molecular weight of 232.37 g/mol, XLogP of 2.85, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-methylcyclopentyl)-1-phenylpropane-1,3-diamine is sourced from PubChem (CID 114547321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).