N-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide

C19H21F2N3O2 — CID 24640357

IUPACN-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide
SMILESCCCC(NC(=O)NCc1ccc(F)cc1)C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C19H21F2N3O2/c1-2-3-17(18(25)23-16-10-8-15(21)9-11-16)24-19(26)22-12-13-4-6-14(20)7-5-13/h4-11,17H,2-3,12H2,1H3,(H,23,25)(H2,22,24,26)
InChIKeyLRMQTABMDAWBFI-UHFFFAOYSA-N
MW361.39 g/mol
LogP3.57
Rot. Bonds7

About N-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide

N-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide (PubChem CID 24640357) has the molecular formula C19H21F2N3O2 and a molecular weight of 361.39 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide
PubChem CID24640357
Molecular FormulaC19H21F2N3O2
Molecular Weight361.39 g/mol
Exact Mass361.16
IUPAC NameN-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide
SMILESCCCC(NC(=O)NCc1ccc(F)cc1)C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C19H21F2N3O2/c1-2-3-17(18(25)23-16-10-8-15(21)9-11-16)24-19(26)22-12-13-4-6-14(20)7-5-13/h4-11,17H,2-3,12H2,1H3,(H,23,25)(H2,22,24,26)
InChIKeyLRMQTABMDAWBFI-UHFFFAOYSA-N
XLogP3.57
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.39
LogP ≤ 53.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-fluorophenyl)methylcarbamoylamino]-N-(6-methoxy-3-pyridinyl)pentanamide
CID 24605807
N-(4-chloro-3-cyanophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide
CID 55541822
methyl 2-chloro-5-[2-[(4-fluorophenyl)methylcarbamoylamino]pentanoylamino]benzoate
CID 55556722
N-(2-acetamidoethyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide
CID 134057507
2-[(4-fluorophenyl)methylcarbamoylamino]-N-(1H-indazol-5-yl)pentanamide
CID 71943301
(2S)-2-[(4-fluorophenyl)methylcarbamoylamino]-N-(2-methyl-1,3-benzoxazol-5-yl)pentanamide
CID 41181659
(2R)-2-[(4-fluorophenyl)methylcarbamoylamino]-N-(2-methoxyethyl)pentanamide
CID 99808381
2-[(4-fluorophenyl)methylcarbamoylamino]-N-(4-methoxy-3-sulfamoylphenyl)pentanamide
CID 24634494
N-(cyclohexylmethyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide
CID 24678029
2-[(4-fluorophenyl)methylcarbamoylamino]-N-phenylmethoxypentanamide
CID 51323356
N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide
CID 43066891
(2S)-2-[(4-fluorophenyl)methylcarbamoylamino]-N-(pyridin-2-ylmethyl)pentanamide
CID 36714136

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide?
The IUPAC name of N-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide (CID 24640357) is N-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide?
The canonical SMILES for N-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide is CCCC(NC(=O)NCc1ccc(F)cc1)C(=O)Nc1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide?
The InChIKey is LRMQTABMDAWBFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F2N3O2/c1-2-3-17(18(25)23-16-10-8-15(21)9-11-16)24-19(26)22-12-13-4-6-14(20)7-5-13/h4-11,17H,2-3,12H2,1H3,(H,23,25)(H2,22,24,26).
What are the key properties of N-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide?
N-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide has a molecular weight of 361.39 g/mol, XLogP of 3.57, 7 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-[(4-fluorophenyl)methylcarbamoylamino]pentanamide is sourced from PubChem (CID 24640357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).