1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine

C11H14F2N2 — CID 102571502

IUPAC1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine
SMILESNC1CCCC1Nc1ccc(F)c(F)c1
InChIInChI=1S/C11H14F2N2/c12-8-5-4-7(6-9(8)13)15-11-3-1-2-10(11)14/h4-6,10-11,15H,1-3,14H2
InChIKeySGLYJMFKFVWGQM-UHFFFAOYSA-N
MW212.24 g/mol
LogP2.26
Rot. Bonds2

About 1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine

1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine (PubChem CID 102571502) has the molecular formula C11H14F2N2 and a molecular weight of 212.24 g/mol. Its IUPAC name is 1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine.

Molecular Properties

Compound Name1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine
PubChem CID102571502
Molecular FormulaC11H14F2N2
Molecular Weight212.24 g/mol
Exact Mass212.11
IUPAC Name1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine
SMILESNC1CCCC1Nc1ccc(F)c(F)c1
InChIInChI=1S/C11H14F2N2/c12-8-5-4-7(6-9(8)13)15-11-3-1-2-10(11)14/h4-6,10-11,15H,1-3,14H2
InChIKeySGLYJMFKFVWGQM-UHFFFAOYSA-N
XLogP2.26
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.24
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-(3-fluoro-4-methoxyphenyl)cyclopentane-1,2-diamine
CID 115117101
trans-(1S,2S)-2-(3,4-difluoroanilino)cyclohexan-1-ol
CID 102730932
N-(2,3-dimethylcyclohexyl)-3,4-difluoroaniline
CID 64776370
1-N-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclopentane-1,2-diamine
CID 115117098
N-(2-tert-butylcyclohexyl)-3,4-difluoroaniline
CID 43095485
3,4-difluoro-N-(2-methoxycyclohexyl)aniline
CID 43761652
1-N-(2,6-difluorophenyl)cyclopentane-1,2-diamine
CID 102571496
1-N-(4-phenylphenyl)cyclopentane-1,2-diamine
CID 115117122
1-N-(4-ethylphenyl)cyclopentane-1,2-diamine
CID 102571486
N-(3,4-difluorophenyl)-4-methylcycloheptan-1-amine
CID 65081163
(2R,3R)-N-(3,4-difluorophenyl)-2-methyloxolan-3-amine
CID 97358475
1-N-[2-(3,4-difluorophenyl)-2-methylpropyl]cyclopentane-1,2-diamine
CID 115117729

Frequently Asked Questions

What is the IUPAC name of 1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine?
The IUPAC name of 1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine (CID 102571502) is 1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine.
What is the SMILES notation for 1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine?
The canonical SMILES for 1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine is NC1CCCC1Nc1ccc(F)c(F)c1.
What is the InChIKey of 1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine?
The InChIKey is SGLYJMFKFVWGQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N2/c12-8-5-4-7(6-9(8)13)15-11-3-1-2-10(11)14/h4-6,10-11,15H,1-3,14H2.
What are the key properties of 1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine?
1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine has a molecular weight of 212.24 g/mol, XLogP of 2.26, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(3,4-difluorophenyl)cyclopentane-1,2-diamine is sourced from PubChem (CID 102571502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).