1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea

C14H23N5O — CID 113039134

IUPAC1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea
SMILESCC(C)NC(=O)Nc1ccc(NC2CCCCC2)nn1
InChIInChI=1S/C14H23N5O/c1-10(2)15-14(20)17-13-9-8-12(18-19-13)16-11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3,(H,16,18)(H2,15,17,19,20)
InChIKeyVEINKLZNNCTOQM-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.75
Rot. Bonds4

About 1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea

1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea (PubChem CID 113039134) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea.

Molecular Properties

Compound Name1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea
PubChem CID113039134
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea
SMILESCC(C)NC(=O)Nc1ccc(NC2CCCCC2)nn1
InChIInChI=1S/C14H23N5O/c1-10(2)15-14(20)17-13-9-8-12(18-19-13)16-11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3,(H,16,18)(H2,15,17,19,20)
InChIKeyVEINKLZNNCTOQM-UHFFFAOYSA-N
XLogP2.75
TPSA78.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-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-[6-(cyclopentylamino)pyridazin-3-yl]-3-propan-2-ylurea
CID 113038888
1-[5-(cyclohexylamino)-2-pyridinyl]-3-propan-2-ylurea
CID 113024752
N-[6-(cyclopentylamino)pyridazin-3-yl]-3-methylbutanamide
CID 113038820
N-[6-(cycloheptylamino)pyridazin-3-yl]-2-ethylbutanamide
CID 113044367
1-[6-(cyclopentylamino)pyridazin-3-yl]-3-phenylurea
CID 113038878
N-[6-(cycloheptylamino)pyridazin-3-yl]-4-methylbenzamide
CID 113044373
N-[6-(cycloheptylamino)pyridazin-3-yl]-2,6-dimethoxybenzamide
CID 113044384
N-butan-2-yl-6-(cyclohexylamino)pyridazine-3-carboxamide
CID 109111540
1-cyclohexyl-3-[6-(1-phenylethylamino)pyridazin-3-yl]urea
CID 113041212
6-(cyclooctylamino)pyridazine-3-carboxylic acid
CID 60792420
N-[6-(cyclopentylamino)pyridazin-3-yl]benzamide
CID 113038827
N-[6-(cyclopentylamino)pyridazin-3-yl]-2,2-diphenylacetamide
CID 113038844

Frequently Asked Questions

What is the IUPAC name of 1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea?
The IUPAC name of 1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea (CID 113039134) is 1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea.
What is the SMILES notation for 1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea?
The canonical SMILES for 1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea is CC(C)NC(=O)Nc1ccc(NC2CCCCC2)nn1.
What is the InChIKey of 1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea?
The InChIKey is VEINKLZNNCTOQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-10(2)15-14(20)17-13-9-8-12(18-19-13)16-11-6-4-3-5-7-11/h8-11H,3-7H2,1-2H3,(H,16,18)(H2,15,17,19,20).
What are the key properties of 1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea?
1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea has a molecular weight of 277.37 g/mol, XLogP of 2.75, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(cyclohexylamino)pyridazin-3-yl]-3-propan-2-ylurea is sourced from PubChem (CID 113039134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).