1-cyclopentyl-N-phenylethane-1,2-diamine

C13H20N2 — CID 65380108

IUPAC1-cyclopentyl-N-phenylethane-1,2-diamine
SMILESNCC(Nc1ccccc1)C1CCCC1
InChIInChI=1S/C13H20N2/c14-10-13(11-6-4-5-7-11)15-12-8-2-1-3-9-12/h1-3,8-9,11,13,15H,4-7,10,14H2
InChIKeyZQTZDRQRPOEVBG-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.62
Rot. Bonds4

About 1-cyclopentyl-N-phenylethane-1,2-diamine

1-cyclopentyl-N-phenylethane-1,2-diamine (PubChem CID 65380108) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is 1-cyclopentyl-N-phenylethane-1,2-diamine.

Molecular Properties

Compound Name1-cyclopentyl-N-phenylethane-1,2-diamine
PubChem CID65380108
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name1-cyclopentyl-N-phenylethane-1,2-diamine
SMILESNCC(Nc1ccccc1)C1CCCC1
InChIInChI=1S/C13H20N2/c14-10-13(11-6-4-5-7-11)15-12-8-2-1-3-9-12/h1-3,8-9,11,13,15H,4-7,10,14H2
InChIKeyZQTZDRQRPOEVBG-UHFFFAOYSA-N
XLogP2.62
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-anilino-2-cyclopentylethanol
CID 62071600
N-(2-bromophenyl)-1-cyclopentylethane-1,2-diamine
CID 65385964
1-cyclopentyl-N-[2-(trifluoromethyl)phenyl]ethane-1,2-diamine
CID 106738164
N-(1-cyclopropylpropyl)aniline;hydrochloride
CID 174269039
1-cyclohexyl-N-(2-phenylethyl)ethane-1,2-diamine
CID 57365235
1-cyclopentyl-N-(2-nitrophenyl)ethane-1,2-diamine
CID 106738241
N-(3-chloro-4-methylphenyl)-1-cyclohexylethane-1,2-diamine
CID 104721878
N-(2-amino-1-cyclohexylethyl)benzenesulfonamide
CID 61122381
1-cyclopentyl-N-(4-fluoro-3-methoxyphenyl)ethane-1,2-diamine
CID 114839107
1-cyclopentyl-N-([1,2,4]triazolo[1,5-a]pyridin-2-yl)ethane-1,2-diamine
CID 106738088
N-cinnolin-4-yl-1-cyclopentylethane-1,2-diamine
CID 106738352
N-(1,3-benzoxazol-2-yl)-1-cyclohexylethane-1,2-diamine
CID 115309571

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-phenylethane-1,2-diamine?
The IUPAC name of 1-cyclopentyl-N-phenylethane-1,2-diamine (CID 65380108) is 1-cyclopentyl-N-phenylethane-1,2-diamine.
What is the SMILES notation for 1-cyclopentyl-N-phenylethane-1,2-diamine?
The canonical SMILES for 1-cyclopentyl-N-phenylethane-1,2-diamine is NCC(Nc1ccccc1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-phenylethane-1,2-diamine?
The InChIKey is ZQTZDRQRPOEVBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c14-10-13(11-6-4-5-7-11)15-12-8-2-1-3-9-12/h1-3,8-9,11,13,15H,4-7,10,14H2.
What are the key properties of 1-cyclopentyl-N-phenylethane-1,2-diamine?
1-cyclopentyl-N-phenylethane-1,2-diamine has a molecular weight of 204.32 g/mol, XLogP of 2.62, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-phenylethane-1,2-diamine is sourced from PubChem (CID 65380108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).