1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide

C15H21FN2O2 — CID 119335506

IUPAC1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide
SMILESCC(CNC(=O)C1(N)CCCC1)Oc1ccc(F)cc1
InChIInChI=1S/C15H21FN2O2/c1-11(20-13-6-4-12(16)5-7-13)10-18-14(19)15(17)8-2-3-9-15/h4-7,11H,2-3,8-10,17H2,1H3,(H,18,19)
InChIKeyXNMMHPZHXURJCK-UHFFFAOYSA-N
MW280.34 g/mol
LogP1.98
Rot. Bonds5

About 1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide

1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide (PubChem CID 119335506) has the molecular formula C15H21FN2O2 and a molecular weight of 280.34 g/mol. Its IUPAC name is 1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide
PubChem CID119335506
Molecular FormulaC15H21FN2O2
Molecular Weight280.34 g/mol
Exact Mass280.16
IUPAC Name1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide
SMILESCC(CNC(=O)C1(N)CCCC1)Oc1ccc(F)cc1
InChIInChI=1S/C15H21FN2O2/c1-11(20-13-6-4-12(16)5-7-13)10-18-14(19)15(17)8-2-3-9-15/h4-7,11H,2-3,8-10,17H2,1H3,(H,18,19)
InChIKeyXNMMHPZHXURJCK-UHFFFAOYSA-N
XLogP1.98
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-N-[2-(4-chlorophenoxy)propyl]cyclohexane-1-carboxamide;hydrochloride
CID 119335598
1-amino-N-[2-(4-fluorophenyl)-2-methoxyethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119343019
N-[2-(4-fluorophenoxy)propyl]-4-(methoxymethyl)piperidine-4-carboxamide;hydrochloride
CID 120636214
1-amino-N-[2-(dimethylamino)-2-(4-fluorophenyl)ethyl]cyclohexane-1-carboxamide
CID 119850679
N-[2-(4-fluorophenoxy)propyl]-2-methoxyacetamide
CID 71994274
N-[2-(4-fluorophenoxy)propyl]-2-methyl-3-(methylamino)propanamide
CID 119804487
methyl (2R)-4-[[(2S)-2-(4-fluorophenoxy)propyl]amino]-2-methyl-4-oxobutanoate
CID 96542660
1-amino-N-(4-butan-2-yloxyphenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119298195
1-amino-N-[(1S)-1-(4-fluorophenyl)ethyl]cyclohexane-1-carboxamide
CID 81350015
1-[2-(4-fluorophenoxy)propyl]-3-(2-hydroxycyclohexyl)urea
CID 111508697
1-amino-N-[(2S)-2-hydroxypropyl]cyclopentane-1-carboxamide
CID 93315414
N-[2-[(1-aminocyclopentanecarbonyl)amino]ethyl]-4-fluorobenzamide;hydrochloride
CID 119299556

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide (CID 119335506) is 1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide is CC(CNC(=O)C1(N)CCCC1)Oc1ccc(F)cc1.
What is the InChIKey of 1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide?
The InChIKey is XNMMHPZHXURJCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2/c1-11(20-13-6-4-12(16)5-7-13)10-18-14(19)15(17)8-2-3-9-15/h4-7,11H,2-3,8-10,17H2,1H3,(H,18,19).
What are the key properties of 1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide?
1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide has a molecular weight of 280.34 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[2-(4-fluorophenoxy)propyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119335506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).