1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea

C11H15N3O — CID 115575131

IUPAC1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea
SMILESCC(NC(=O)NC1CC1)c1ccncc1
InChIInChI=1S/C11H15N3O/c1-8(9-4-6-12-7-5-9)13-11(15)14-10-2-3-10/h4-8,10H,2-3H2,1H3,(H2,13,14,15)
InChIKeyIAICXPDOQPFNRN-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.60
Rot. Bonds3

About 1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea

1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea (PubChem CID 115575131) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea.

Molecular Properties

Compound Name1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea
PubChem CID115575131
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea
SMILESCC(NC(=O)NC1CC1)c1ccncc1
InChIInChI=1S/C11H15N3O/c1-8(9-4-6-12-7-5-9)13-11(15)14-10-2-3-10/h4-8,10H,2-3H2,1H3,(H2,13,14,15)
InChIKeyIAICXPDOQPFNRN-UHFFFAOYSA-N
XLogP1.60
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea 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-(oxolan-3-yl)-3-(1-pyridin-4-ylethyl)urea
CID 115758270
1-cyclopropyl-3-(1-phenylethyl)urea
CID 42924486
2-[4-[[(1S)-1-pyridin-4-ylethyl]carbamoylamino]piperidin-1-yl]acetamide
CID 95159118
tert-butyl (3R)-3-[[(1S)-1-pyridin-4-ylethyl]carbamoylamino]pyrrolidine-1-carboxylate
CID 96516600
1-propan-2-yl-3-(1-pyridin-4-ylethyl)urea
CID 110748295
1-cyclohexyl-3-[(1R)-1-phenylethyl]urea
CID 840473
1-cyclopentyl-3-[1-(4-methylphenyl)ethyl]urea
CID 47322191
4-(1-pyridin-3-ylethylcarbamoylamino)cyclohexane-1-carboxylic acid
CID 61196946
1-cyclohexyl-3-[(1R)-1-(4-methylphenyl)ethyl]urea
CID 94192175
1-[(1R,2R)-2-ethylsulfanylcyclohexyl]-3-[(1R)-1-pyridin-4-ylethyl]urea
CID 98775732
4-[[(1R)-1-(4-chlorophenyl)ethyl]carbamoylamino]cyclohexane-1-carboxylic acid
CID 122017510
1-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]-3-(1-pyridin-4-ylethyl)urea
CID 111630344

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea?
The IUPAC name of 1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea (CID 115575131) is 1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea.
What is the SMILES notation for 1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea?
The canonical SMILES for 1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea is CC(NC(=O)NC1CC1)c1ccncc1.
What is the InChIKey of 1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea?
The InChIKey is IAICXPDOQPFNRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-8(9-4-6-12-7-5-9)13-11(15)14-10-2-3-10/h4-8,10H,2-3H2,1H3,(H2,13,14,15).
What are the key properties of 1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea?
1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea has a molecular weight of 205.26 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(1-pyridin-4-ylethyl)urea is sourced from PubChem (CID 115575131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).