N-(benzhydrylcarbamoylamino)formamide

C15H15N3O2 — CID 86019653

IUPACN-(benzhydrylcarbamoylamino)formamide
SMILESO=CNNC(=O)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15N3O2/c19-11-16-18-15(20)17-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-11,14H,(H,16,19)(H2,17,18,20)
InChIKeySASZLHQJOSHKPP-UHFFFAOYSA-N
MW269.30 g/mol
LogP1.74
Rot. Bonds5

About N-(benzhydrylcarbamoylamino)formamide

N-(benzhydrylcarbamoylamino)formamide (PubChem CID 86019653) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-(benzhydrylcarbamoylamino)formamide.

Molecular Properties

Compound NameN-(benzhydrylcarbamoylamino)formamide
PubChem CID86019653
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC NameN-(benzhydrylcarbamoylamino)formamide
SMILESO=CNNC(=O)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15N3O2/c19-11-16-18-15(20)17-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-11,14H,(H,16,19)(H2,17,18,20)
InChIKeySASZLHQJOSHKPP-UHFFFAOYSA-N
XLogP1.74
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 51.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(benzhydrylcarbamoylamino)acetic acid
CID 43445708
N-(benzhydrylcarbamoyl)benzamide
CID 2850647
1-benzhydryl-3-[(E)-3,3-dimethylbut-1-enyl]urea
CID 108911309
1-benzhydryl-3-(4-phenylphenyl)urea
CID 108867015
1-benzhydryl-3-(2-chlorophenyl)urea
CID 108867386
N-[4-(benzhydrylcarbamoylamino)phenyl]acetamide
CID 108867378
3-(benzhydrylcarbamoylamino)propanoic acid
CID 108867375
1-benzhydryl-3-prop-2-ynylurea
CID 41304336
1-methyl-3-[phenyl(pyridin-4-yl)methyl]urea;hydrochloride
CID 24847582
N-benzhydrylbut-2-enamide
CID 78906490
1-benzhydryl-3-(cyclohexylmethyl)urea
CID 108902827
N-benzhydryl-2-formamido-2-(2-hydroxyphenyl)acetamide
CID 171982607

Frequently Asked Questions

What is the IUPAC name of N-(benzhydrylcarbamoylamino)formamide?
The IUPAC name of N-(benzhydrylcarbamoylamino)formamide (CID 86019653) is N-(benzhydrylcarbamoylamino)formamide.
What is the SMILES notation for N-(benzhydrylcarbamoylamino)formamide?
The canonical SMILES for N-(benzhydrylcarbamoylamino)formamide is O=CNNC(=O)NC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(benzhydrylcarbamoylamino)formamide?
The InChIKey is SASZLHQJOSHKPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c19-11-16-18-15(20)17-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-11,14H,(H,16,19)(H2,17,18,20).
What are the key properties of N-(benzhydrylcarbamoylamino)formamide?
N-(benzhydrylcarbamoylamino)formamide has a molecular weight of 269.30 g/mol, XLogP of 1.74, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(benzhydrylcarbamoylamino)formamide is sourced from PubChem (CID 86019653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).