1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea

C15H27N5O2 — CID 53498203

IUPAC1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea
SMILESCC(C)CC(CNC(=O)NCc1ccn[nH]1)N1CCOCC1
InChIInChI=1S/C15H27N5O2/c1-12(2)9-14(20-5-7-22-8-6-20)11-17-15(21)16-10-13-3-4-18-19-13/h3-4,12,14H,5-11H2,1-2H3,(H,18,19)(H2,16,17,21)
InChIKeyHQSCKFSIDPVMOU-UHFFFAOYSA-N
MW309.41 g/mol
LogP0.96
Rot. Bonds7

About 1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea

1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea (PubChem CID 53498203) has the molecular formula C15H27N5O2 and a molecular weight of 309.41 g/mol. Its IUPAC name is 1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea.

Molecular Properties

Compound Name1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea
PubChem CID53498203
Molecular FormulaC15H27N5O2
Molecular Weight309.41 g/mol
Exact Mass309.22
IUPAC Name1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea
SMILESCC(C)CC(CNC(=O)NCc1ccn[nH]1)N1CCOCC1
InChIInChI=1S/C15H27N5O2/c1-12(2)9-14(20-5-7-22-8-6-20)11-17-15(21)16-10-13-3-4-18-19-13/h3-4,12,14H,5-11H2,1-2H3,(H,18,19)(H2,16,17,21)
InChIKeyHQSCKFSIDPVMOU-UHFFFAOYSA-N
XLogP0.96
TPSA82.28 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 50.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea?
The IUPAC name of 1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea (CID 53498203) is 1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea.
What is the SMILES notation for 1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea?
The canonical SMILES for 1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea is CC(C)CC(CNC(=O)NCc1ccn[nH]1)N1CCOCC1.
What is the InChIKey of 1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea?
The InChIKey is HQSCKFSIDPVMOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O2/c1-12(2)9-14(20-5-7-22-8-6-20)11-17-15(21)16-10-13-3-4-18-19-13/h3-4,12,14H,5-11H2,1-2H3,(H,18,19)(H2,16,17,21).
What are the key properties of 1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea?
1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea has a molecular weight of 309.41 g/mol, XLogP of 0.96, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-2-morpholin-4-ylpentyl)-3-(1H-pyrazol-5-ylmethyl)urea is sourced from PubChem (CID 53498203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).