2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide

C15H21FN2O — CID 119293600

IUPAC2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide
SMILESCCCC(N)C(=O)NCC1(c2ccc(F)cc2)CC1
InChIInChI=1S/C15H21FN2O/c1-2-3-13(17)14(19)18-10-15(8-9-15)11-4-6-12(16)7-5-11/h4-7,13H,2-3,8-10,17H2,1H3,(H,18,19)
InChIKeyHAIGEEKSEHWNPP-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.10
Rot. Bonds6

About 2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide

2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide (PubChem CID 119293600) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is 2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide.

Molecular Properties

Compound Name2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide
PubChem CID119293600
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC Name2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide
SMILESCCCC(N)C(=O)NCC1(c2ccc(F)cc2)CC1
InChIInChI=1S/C15H21FN2O/c1-2-3-13(17)14(19)18-10-15(8-9-15)11-4-6-12(16)7-5-11/h4-7,13H,2-3,8-10,17H2,1H3,(H,18,19)
InChIKeyHAIGEEKSEHWNPP-UHFFFAOYSA-N
XLogP2.10
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-4-methylsulfanylbutanamide
CID 119293591
2-amino-N-[(1-phenylcyclopropyl)methyl]pentanamide;hydrochloride
CID 119276377
(2S)-2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-4-methylpentanamide
CID 110482473
(2R)-2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]propanamide
CID 119293598
2-amino-N-[[1-(4-bromophenyl)cyclobutyl]methyl]pentanamide;hydrochloride
CID 119301083
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methylpropanamide
CID 42266064
3-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]butanamide
CID 119731231
N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-2-methyl-3-(methylamino)propanamide
CID 119731221
(2S)-2-amino-N-[[1-(4-fluorophenyl)cyclopentyl]methyl]-3-phenylpropanamide
CID 119293561
1-butan-2-yl-3-[[1-(4-fluorophenyl)cyclopropyl]methyl]urea
CID 113214285
ethyl 2-[[1-(4-fluorophenyl)cyclopropyl]methylamino]-2-oxoacetate
CID 110481833
1-[[1-(4-fluorophenyl)cyclopropyl]methyl]-3-pentylurea
CID 78885818

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide?
The IUPAC name of 2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide (CID 119293600) is 2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide.
What is the SMILES notation for 2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide?
The canonical SMILES for 2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide is CCCC(N)C(=O)NCC1(c2ccc(F)cc2)CC1.
What is the InChIKey of 2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide?
The InChIKey is HAIGEEKSEHWNPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-2-3-13(17)14(19)18-10-15(8-9-15)11-4-6-12(16)7-5-11/h4-7,13H,2-3,8-10,17H2,1H3,(H,18,19).
What are the key properties of 2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide?
2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide has a molecular weight of 264.34 g/mol, XLogP of 2.10, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[[1-(4-fluorophenyl)cyclopropyl]methyl]pentanamide is sourced from PubChem (CID 119293600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).