1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea

C19H20N4O2 — CID 90597839

IUPAC1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea
SMILESO=C(Nc1cnn(C2CCOCC2)c1)Nc1cccc2ccccc12
InChIInChI=1S/C19H20N4O2/c24-19(22-18-7-3-5-14-4-1-2-6-17(14)18)21-15-12-20-23(13-15)16-8-10-25-11-9-16/h1-7,12-13,16H,8-11H2,(H2,21,22,24)
InChIKeyCJWSSTWFEDPRMJ-UHFFFAOYSA-N
MW336.39 g/mol
LogP4.03
Rot. Bonds3

About 1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea

1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea (PubChem CID 90597839) has the molecular formula C19H20N4O2 and a molecular weight of 336.39 g/mol. Its IUPAC name is 1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea.

Molecular Properties

Compound Name1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea
PubChem CID90597839
Molecular FormulaC19H20N4O2
Molecular Weight336.39 g/mol
Exact Mass336.16
IUPAC Name1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea
SMILESO=C(Nc1cnn(C2CCOCC2)c1)Nc1cccc2ccccc12
InChIInChI=1S/C19H20N4O2/c24-19(22-18-7-3-5-14-4-1-2-6-17(14)18)21-15-12-20-23(13-15)16-8-10-25-11-9-16/h1-7,12-13,16H,8-11H2,(H2,21,22,24)
InChIKeyCJWSSTWFEDPRMJ-UHFFFAOYSA-N
XLogP4.03
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]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-benzyl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea
CID 90597826
1-(2-fluorophenyl)-3-[1-[(3R)-oxolan-3-yl]pyrazol-4-yl]urea
CID 97428185
1-cyclopentyl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea
CID 90597838
2,2,2-trifluoro-N-[1-(oxan-4-yl)pyrazol-4-yl]acetamide
CID 90597743
N-[1-(oxan-4-yl)pyrazol-4-yl]cyclopentanecarboxamide
CID 71810169
N-[1-(oxan-4-yl)pyrazol-4-yl]thiophene-2-carboxamide
CID 71810204
1-(2-methoxyethyl)-3-[1-(oxan-4-yl)pyrazol-4-yl]urea
CID 71810282
1-naphthalen-1-yl-3-[4-(naphthalen-1-ylcarbamoylamino)phenyl]urea
CID 23966866
1-[1-[(4-chlorophenyl)methyl]pyrazol-4-yl]-3-naphthalen-1-ylurea
CID 17266709
(E)-4-[[1-(oxan-4-yl)pyrazol-4-yl]amino]-4-oxobut-2-enoic acid
CID 122172610
[1-(oxan-4-yl)pyrazol-4-yl]thiourea
CID 145069012
1-(2-ethoxyphenyl)-3-[1-(oxan-4-ylmethyl)pyrazol-4-yl]urea
CID 90622357

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea?
The IUPAC name of 1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea (CID 90597839) is 1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea.
What is the SMILES notation for 1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea?
The canonical SMILES for 1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea is O=C(Nc1cnn(C2CCOCC2)c1)Nc1cccc2ccccc12.
What is the InChIKey of 1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea?
The InChIKey is CJWSSTWFEDPRMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c24-19(22-18-7-3-5-14-4-1-2-6-17(14)18)21-15-12-20-23(13-15)16-8-10-25-11-9-16/h1-7,12-13,16H,8-11H2,(H2,21,22,24).
What are the key properties of 1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea?
1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea has a molecular weight of 336.39 g/mol, XLogP of 4.03, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-yl-3-[1-(oxan-4-yl)pyrazol-4-yl]urea is sourced from PubChem (CID 90597839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).