N-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide

C18H20N2O2 — CID 59095975

IUPACN-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide
SMILESCCC(c1ccc(NC=O)cc1)c1ccc(NC(C)=O)cc1
InChIInChI=1S/C18H20N2O2/c1-3-18(14-4-8-16(9-5-14)19-12-21)15-6-10-17(11-7-15)20-13(2)22/h4-12,18H,3H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyDGVAOQVHQZFAPF-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.76
Rot. Bonds6

About N-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide

N-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide (PubChem CID 59095975) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is N-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide
PubChem CID59095975
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC NameN-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide
SMILESCCC(c1ccc(NC=O)cc1)c1ccc(NC(C)=O)cc1
InChIInChI=1S/C18H20N2O2/c1-3-18(14-4-8-16(9-5-14)19-12-21)15-6-10-17(11-7-15)20-13(2)22/h4-12,18H,3H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyDGVAOQVHQZFAPF-UHFFFAOYSA-N
XLogP3.76
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

[2-(4-acetamidophenyl)-2-(4-formamidophenyl)ethyl] methanesulfonate
CID 20632825
3,3-bis(4-acetamidophenyl)propanoic acid
CID 20632812
methyl 2-(4-formamidophenyl)propanoate
CID 11356229
N-[4-[bis(4-formamidophenyl)methyl]phenyl]formamide
CID 22490733
(2S)-N-(4-acetamidophenyl)-2-methylbutanamide
CID 837961
N-[4-[3-(4-acetamidophenyl)-1,3-dichloro-2-oxopropyl]phenyl]acetamide
CID 139644819
(3S)-3-(4-acetamidophenyl)-3-hydroxypropanoic acid
CID 95997401
2-[[2-(4-acetamidophenyl)-2-hydroxyethyl]amino]acetic acid
CID 82314595
N-[4-[(1S,2R)-1-amino-2-hydroxy-3-methylpentyl]phenyl]acetamide
CID 171268646
N-[4-[(1R)-1-amino-2-methylbutyl]phenyl]acetamide;hydrochloride
CID 171206638
2-[[1-(4-acetamidophenyl)-1-hydroxybutan-2-yl]amino]acetic acid
CID 82314656
N-[4-(1-amino-2-fluoroethyl)phenyl]acetamide
CID 130059747

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide?
The IUPAC name of N-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide (CID 59095975) is N-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide?
The canonical SMILES for N-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide is CCC(c1ccc(NC=O)cc1)c1ccc(NC(C)=O)cc1.
What is the InChIKey of N-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide?
The InChIKey is DGVAOQVHQZFAPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-3-18(14-4-8-16(9-5-14)19-12-21)15-6-10-17(11-7-15)20-13(2)22/h4-12,18H,3H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide?
N-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide has a molecular weight of 296.37 g/mol, XLogP of 3.76, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-(4-formamidophenyl)propyl]phenyl]acetamide is sourced from PubChem (CID 59095975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).