N-[(3-propylbenzoyl)amino]formamide

C11H14N2O2 — CID 143851334

IUPACN-[(3-propylbenzoyl)amino]formamide
SMILESCCCc1cccc(C(=O)NNC=O)c1
InChIInChI=1S/C11H14N2O2/c1-2-4-9-5-3-6-10(7-9)11(15)13-12-8-14/h3,5-8H,2,4H2,1H3,(H,12,14)(H,13,15)
InChIKeyKURHRQAUABNQPX-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.03
Rot. Bonds5

About N-[(3-propylbenzoyl)amino]formamide

N-[(3-propylbenzoyl)amino]formamide (PubChem CID 143851334) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is N-[(3-propylbenzoyl)amino]formamide.

Molecular Properties

Compound NameN-[(3-propylbenzoyl)amino]formamide
PubChem CID143851334
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC NameN-[(3-propylbenzoyl)amino]formamide
SMILESCCCc1cccc(C(=O)NNC=O)c1
InChIInChI=1S/C11H14N2O2/c1-2-4-9-5-3-6-10(7-9)11(15)13-12-8-14/h3,5-8H,2,4H2,1H3,(H,12,14)(H,13,15)
InChIKeyKURHRQAUABNQPX-UHFFFAOYSA-N
XLogP1.03
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.03
H-Bond Donors ≤ 52
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

N-[2-(ethylamino)-2-oxoethyl]-3-propylbenzamide
CID 71109879
methyl 3-propylbenzoate
CID 12861009
N-[(3-aminobenzoyl)amino]formamide
CID 142270401
N-(4-fluorophenyl)-3-propylbenzamide
CID 67124945
2-amino-1-(3-propylphenyl)ethanone
CID 116548428
3-(2-phenylethyl)-N-propylbenzamide
CID 67214540
N-(4-ethyl-3-methylphenyl)-3-propylbenzamide
CID 142077280
(3,5-dimethylphenyl)-(3-propylphenyl)methanone
CID 115811990
1-prop-1-en-2-yl-3-propylbenzene
CID 22486655
1-buta-1,3-dien-2-yl-3-propylbenzene
CID 140596687
1-(3-propylphenyl)heptan-1-one
CID 115812204
2-hydroxy-1-(3-propylphenyl)pentan-1-one
CID 103453885

Frequently Asked Questions

What is the IUPAC name of N-[(3-propylbenzoyl)amino]formamide?
The IUPAC name of N-[(3-propylbenzoyl)amino]formamide (CID 143851334) is N-[(3-propylbenzoyl)amino]formamide.
What is the SMILES notation for N-[(3-propylbenzoyl)amino]formamide?
The canonical SMILES for N-[(3-propylbenzoyl)amino]formamide is CCCc1cccc(C(=O)NNC=O)c1.
What is the InChIKey of N-[(3-propylbenzoyl)amino]formamide?
The InChIKey is KURHRQAUABNQPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-2-4-9-5-3-6-10(7-9)11(15)13-12-8-14/h3,5-8H,2,4H2,1H3,(H,12,14)(H,13,15).
What are the key properties of N-[(3-propylbenzoyl)amino]formamide?
N-[(3-propylbenzoyl)amino]formamide has a molecular weight of 206.25 g/mol, XLogP of 1.03, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-propylbenzoyl)amino]formamide is sourced from PubChem (CID 143851334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).