1-phenyl-1-propyl-3-pyridin-3-ylurea

C15H17N3O — CID 30845452

IUPAC1-phenyl-1-propyl-3-pyridin-3-ylurea
SMILESCCCN(C(=O)Nc1cccnc1)c1ccccc1
InChIInChI=1S/C15H17N3O/c1-2-11-18(14-8-4-3-5-9-14)15(19)17-13-7-6-10-16-12-13/h3-10,12H,2,11H2,1H3,(H,17,19)
InChIKeyKDKXHIZOHKYOBQ-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.53
Rot. Bonds4

About 1-phenyl-1-propyl-3-pyridin-3-ylurea

1-phenyl-1-propyl-3-pyridin-3-ylurea (PubChem CID 30845452) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 1-phenyl-1-propyl-3-pyridin-3-ylurea.

Molecular Properties

Compound Name1-phenyl-1-propyl-3-pyridin-3-ylurea
PubChem CID30845452
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name1-phenyl-1-propyl-3-pyridin-3-ylurea
SMILESCCCN(C(=O)Nc1cccnc1)c1ccccc1
InChIInChI=1S/C15H17N3O/c1-2-11-18(14-8-4-3-5-9-14)15(19)17-13-7-6-10-16-12-13/h3-10,12H,2,11H2,1H3,(H,17,19)
InChIKeyKDKXHIZOHKYOBQ-UHFFFAOYSA-N
XLogP3.53
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-phenyl-1-propyl-3-pyridin-3-ylurea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-phenyl-1-propyl-3-pyridin-4-ylurea
CID 134101956
3-[ethyl(pyridin-3-ylcarbamoyl)amino]propanoic acid
CID 61187084
1-ethyl-1-hydroxy-3-pyridin-3-ylurea
CID 130385554
1-(cyclopropylmethyl)-3-phenyl-1-pyridin-3-ylurea
CID 30845448
1-benzyl-1-[2-(diethylamino)ethyl]-3-pyridin-3-ylurea
CID 60591438
2-[tert-butyl(pyridin-3-ylcarbamoyl)amino]acetic acid
CID 79257648
1-(2-hydroxyethyl)-3-[4-[[2-hydroxyethyl(phenyl)carbamoyl]amino]phenyl]-1-phenylurea
CID 122416480
1-(2-hydroxyethyl)-1-(2-phenylethyl)-3-pyridin-3-ylurea
CID 111121985
2-methyl-2-[methyl(pyridin-3-ylcarbamoyl)amino]propanoic acid
CID 62820189
1-anilino-3-pyridin-3-ylurea
CID 47127655
1-(dimethylamino)-3-pyridin-3-ylurea
CID 123360253
N'-ethyl-N'-(3-methylphenyl)-N-pyridin-3-yloxamide
CID 108526043

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-1-propyl-3-pyridin-3-ylurea?
The IUPAC name of 1-phenyl-1-propyl-3-pyridin-3-ylurea (CID 30845452) is 1-phenyl-1-propyl-3-pyridin-3-ylurea.
What is the SMILES notation for 1-phenyl-1-propyl-3-pyridin-3-ylurea?
The canonical SMILES for 1-phenyl-1-propyl-3-pyridin-3-ylurea is CCCN(C(=O)Nc1cccnc1)c1ccccc1.
What is the InChIKey of 1-phenyl-1-propyl-3-pyridin-3-ylurea?
The InChIKey is KDKXHIZOHKYOBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-2-11-18(14-8-4-3-5-9-14)15(19)17-13-7-6-10-16-12-13/h3-10,12H,2,11H2,1H3,(H,17,19).
What are the key properties of 1-phenyl-1-propyl-3-pyridin-3-ylurea?
1-phenyl-1-propyl-3-pyridin-3-ylurea has a molecular weight of 255.32 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-1-propyl-3-pyridin-3-ylurea is sourced from PubChem (CID 30845452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).