N-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide

C15H17FN2O2 — CID 119995910

IUPACN-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide
SMILESCC(CN)CNC(=O)c1ccc(-c2ccc(F)cc2)o1
InChIInChI=1S/C15H17FN2O2/c1-10(8-17)9-18-15(19)14-7-6-13(20-14)11-2-4-12(16)5-3-11/h2-7,10H,8-9,17H2,1H3,(H,18,19)
InChIKeyAWNQCYXAARRLJO-UHFFFAOYSA-N
MW276.31 g/mol
LogP2.41
Rot. Bonds5

About N-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide

N-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide (PubChem CID 119995910) has the molecular formula C15H17FN2O2 and a molecular weight of 276.31 g/mol. Its IUPAC name is N-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide
PubChem CID119995910
Molecular FormulaC15H17FN2O2
Molecular Weight276.31 g/mol
Exact Mass276.13
IUPAC NameN-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide
SMILESCC(CN)CNC(=O)c1ccc(-c2ccc(F)cc2)o1
InChIInChI=1S/C15H17FN2O2/c1-10(8-17)9-18-15(19)14-7-6-13(20-14)11-2-4-12(16)5-3-11/h2-7,10H,8-9,17H2,1H3,(H,18,19)
InChIKeyAWNQCYXAARRLJO-UHFFFAOYSA-N
XLogP2.41
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.31
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-2-methylpropyl)-5-(2-fluorophenyl)furan-2-carboxamide;hydrochloride
CID 119996463
5-(4-fluorophenyl)-N-propan-2-ylfuran-2-carboxamide
CID 4290851
methyl 3-[[5-(4-fluorophenyl)furan-2-carbonyl]amino]propanoate
CID 37351586
N-(2-amino-2-ethylbutyl)-5-(4-fluorophenyl)furan-2-carboxamide;hydrochloride
CID 119643079
N-(3-amino-2-methylpropyl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide;hydrochloride
CID 119997336
methyl 2-[[5-(4-fluorophenyl)furan-2-carbonyl]amino]-4-methylpentanoate
CID 3646174
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-5-(4-fluorophenyl)furan-2-carboxamide
CID 8533422
(2S)-2-[[5-(4-fluorophenyl)furan-2-carbonyl]amino]-3-methylbutanoic acid
CID 94317037
5-(4-fluorophenyl)-N'-[2-(4-fluorophenyl)acetyl]furan-2-carbohydrazide
CID 31725805
N-[(3,4-dimethoxyphenyl)methyl]-5-(4-fluorophenyl)furan-2-carboxamide
CID 9082502
5-(4-fluorophenyl)-N-[3-(methanesulfonamido)propyl]furan-2-carboxamide
CID 37438823
1-[5-(4-fluorophenyl)furan-2-yl]propan-1-one
CID 62632212

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide?
The IUPAC name of N-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide (CID 119995910) is N-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide.
What is the SMILES notation for N-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide?
The canonical SMILES for N-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide is CC(CN)CNC(=O)c1ccc(-c2ccc(F)cc2)o1.
What is the InChIKey of N-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide?
The InChIKey is AWNQCYXAARRLJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O2/c1-10(8-17)9-18-15(19)14-7-6-13(20-14)11-2-4-12(16)5-3-11/h2-7,10H,8-9,17H2,1H3,(H,18,19).
What are the key properties of N-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide?
N-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide has a molecular weight of 276.31 g/mol, XLogP of 2.41, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide is sourced from PubChem (CID 119995910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).