2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide

C14H18F2N2O2 — CID 64822466

IUPAC2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide
SMILESNC1CCCC1C(=O)NCc1ccc(OC(F)F)cc1
InChIInChI=1S/C14H18F2N2O2/c15-14(16)20-10-6-4-9(5-7-10)8-18-13(19)11-2-1-3-12(11)17/h4-7,11-12,14H,1-3,8,17H2,(H,18,19)
InChIKeyWHQZJSHZDZDYRJ-UHFFFAOYSA-N
MW284.31 g/mol
LogP2.03
Rot. Bonds5

About 2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide

2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide (PubChem CID 64822466) has the molecular formula C14H18F2N2O2 and a molecular weight of 284.31 g/mol. Its IUPAC name is 2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide
PubChem CID64822466
Molecular FormulaC14H18F2N2O2
Molecular Weight284.31 g/mol
Exact Mass284.13
IUPAC Name2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide
SMILESNC1CCCC1C(=O)NCc1ccc(OC(F)F)cc1
InChIInChI=1S/C14H18F2N2O2/c15-14(16)20-10-6-4-9(5-7-10)8-18-13(19)11-2-1-3-12(11)17/h4-7,11-12,14H,1-3,8,17H2,(H,18,19)
InChIKeyWHQZJSHZDZDYRJ-UHFFFAOYSA-N
XLogP2.03
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclohexane-1-carboxamide;hydrochloride
CID 119689646
2-amino-N-[(4-chlorophenyl)methyl]cyclopentane-1-carboxamide
CID 64823496
2-amino-N-(pyridin-4-ylmethyl)cyclopentane-1-carboxamide
CID 64824475
2-hydroxy-N-[(4-propan-2-yloxyphenyl)methyl]cyclopentane-1-carboxamide
CID 110013989
2-amino-N-[(4-sulfamoylphenyl)methyl]cyclopentane-1-carboxamide
CID 64818110
N-[(4-acetamidophenyl)methyl]-2-aminocyclopentane-1-carboxamide
CID 64822288
3-amino-N-[[4-(difluoromethoxy)phenyl]methyl]bicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119689643
(2S)-N-[[4-(difluoromethoxy)phenyl]methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119271349
2-cyclopentyl-N-[[4-(difluoromethoxy)phenyl]methyl]acetamide
CID 134029016
1-(aminomethyl)-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide
CID 81485479
2-amino-N-[2-(4-methoxyphenyl)ethyl]cyclopentane-1-carboxamide
CID 64817742
N-[[4-(difluoromethoxy)phenyl]methyl]acetamide
CID 51072984

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide (CID 64822466) is 2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide is NC1CCCC1C(=O)NCc1ccc(OC(F)F)cc1.
What is the InChIKey of 2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide?
The InChIKey is WHQZJSHZDZDYRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O2/c15-14(16)20-10-6-4-9(5-7-10)8-18-13(19)11-2-1-3-12(11)17/h4-7,11-12,14H,1-3,8,17H2,(H,18,19).
What are the key properties of 2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide?
2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide has a molecular weight of 284.31 g/mol, XLogP of 2.03, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[4-(difluoromethoxy)phenyl]methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 64822466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).