1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide

C17H25FN2O — CID 60852822

IUPAC1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide
SMILESCC(C)(C)C(NC(=O)C1(N)CCCC1)c1ccc(F)cc1
InChIInChI=1S/C17H25FN2O/c1-16(2,3)14(12-6-8-13(18)9-7-12)20-15(21)17(19)10-4-5-11-17/h6-9,14H,4-5,10-11,19H2,1-3H3,(H,20,21)
InChIKeyVSYBTOVZPWUZAO-UHFFFAOYSA-N
MW292.40 g/mol
LogP3.30
Rot. Bonds3

About 1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide

1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide (PubChem CID 60852822) has the molecular formula C17H25FN2O and a molecular weight of 292.40 g/mol. Its IUPAC name is 1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide
PubChem CID60852822
Molecular FormulaC17H25FN2O
Molecular Weight292.40 g/mol
Exact Mass292.20
IUPAC Name1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide
SMILESCC(C)(C)C(NC(=O)C1(N)CCCC1)c1ccc(F)cc1
InChIInChI=1S/C17H25FN2O/c1-16(2,3)14(12-6-8-13(18)9-7-12)20-15(21)17(19)10-4-5-11-17/h6-9,14H,4-5,10-11,19H2,1-3H3,(H,20,21)
InChIKeyVSYBTOVZPWUZAO-UHFFFAOYSA-N
XLogP3.30
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide (CID 60852822) is 1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide is CC(C)(C)C(NC(=O)C1(N)CCCC1)c1ccc(F)cc1.
What is the InChIKey of 1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide?
The InChIKey is VSYBTOVZPWUZAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FN2O/c1-16(2,3)14(12-6-8-13(18)9-7-12)20-15(21)17(19)10-4-5-11-17/h6-9,14H,4-5,10-11,19H2,1-3H3,(H,20,21).
What are the key properties of 1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide?
1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide has a molecular weight of 292.40 g/mol, XLogP of 3.30, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[1-(4-fluorophenyl)-2,2-dimethylpropyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 60852822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).