1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea

C11H17N3O2 — CID 110747533

IUPAC1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea
SMILESCc1nc(CNC(=O)NC2CCCC2)co1
InChIInChI=1S/C11H17N3O2/c1-8-13-10(7-16-8)6-12-11(15)14-9-4-2-3-5-9/h7,9H,2-6H2,1H3,(H2,12,14,15)
InChIKeyUHEYRPNOYZFJPR-UHFFFAOYSA-N
MW223.28 g/mol
LogP1.72
Rot. Bonds3

About 1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea

1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea (PubChem CID 110747533) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea.

Molecular Properties

Compound Name1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea
PubChem CID110747533
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea
SMILESCc1nc(CNC(=O)NC2CCCC2)co1
InChIInChI=1S/C11H17N3O2/c1-8-13-10(7-16-8)6-12-11(15)14-9-4-2-3-5-9/h7,9H,2-6H2,1H3,(H2,12,14,15)
InChIKeyUHEYRPNOYZFJPR-UHFFFAOYSA-N
XLogP1.72
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-3-[[2-(methylamino)-1,3-thiazol-4-yl]methyl]urea
CID 110747915
1-[(2-amino-1,3-thiazol-4-yl)methyl]-3-cyclopentylurea
CID 110747812
1-cyclopentyl-3-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]urea
CID 71795572
1-cyclohexyl-3-[(5-methyl-1,3-oxazol-2-yl)methyl]urea
CID 110660494
1-cyclohexyl-3-(1,3-thiazol-5-ylmethyl)urea
CID 104588445
1-[2-(hydroxymethyl)cyclohexyl]-3-[[2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl]urea
CID 111631266
1-cyclobutyl-3-(4-methyl-1,3-oxazol-2-yl)urea
CID 115672499
1-cyclohexyl-3-(furan-3-ylmethyl)urea
CID 47236948
1-[[4-(aminomethyl)phenyl]methyl]-3-cyclohexylurea
CID 54936547
1-cyclohexyl-3-[(3-methyl-4-pyridinyl)methyl]urea
CID 114699395
2-[(cycloheptylcarbamoylamino)methyl]pyridine-4-carboxylic acid
CID 114325102
1-cyclopentyl-3-[(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)methyl]urea
CID 110775535

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea?
The IUPAC name of 1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea (CID 110747533) is 1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea.
What is the SMILES notation for 1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea?
The canonical SMILES for 1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea is Cc1nc(CNC(=O)NC2CCCC2)co1.
What is the InChIKey of 1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea?
The InChIKey is UHEYRPNOYZFJPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-8-13-10(7-16-8)6-12-11(15)14-9-4-2-3-5-9/h7,9H,2-6H2,1H3,(H2,12,14,15).
What are the key properties of 1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea?
1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea has a molecular weight of 223.28 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-[(2-methyl-1,3-oxazol-4-yl)methyl]urea is sourced from PubChem (CID 110747533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).