1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea

C11H18N4O2 — CID 146087715

IUPAC1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea
SMILESCCn1cc(NC(=O)NCC2(O)CCC2)cn1
InChIInChI=1S/C11H18N4O2/c1-2-15-7-9(6-13-15)14-10(16)12-8-11(17)4-3-5-11/h6-7,17H,2-5,8H2,1H3,(H2,12,14,16)
InChIKeyODQIYOHBDIFJPA-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.94
Rot. Bonds4

About 1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea

1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea (PubChem CID 146087715) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea.

Molecular Properties

Compound Name1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea
PubChem CID146087715
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea
SMILESCCn1cc(NC(=O)NCC2(O)CCC2)cn1
InChIInChI=1S/C11H18N4O2/c1-2-15-7-9(6-13-15)14-10(16)12-8-11(17)4-3-5-11/h6-7,17H,2-5,8H2,1H3,(H2,12,14,16)
InChIKeyODQIYOHBDIFJPA-UHFFFAOYSA-N
XLogP0.94
TPSA79.18 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-(1-benzylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea
CID 111521199
1-ethyl-3-(1-ethylpyrazol-4-yl)urea
CID 115581870
1-[(1-ethylpyrazol-4-yl)carbamoylamino]cyclobutane-1-carboxylic acid
CID 81163360
1-butyl-3-(1-ethylpyrazol-4-yl)urea
CID 47200322
1-amino-N-(1-ethylpyrazol-4-yl)cyclopentane-1-carboxamide;hydrochloride
CID 119292190
1-cycloheptyl-3-(1-ethylpyrazol-4-yl)urea
CID 47200421
1-[(1-hydroxycyclobutyl)methyl]-3-pyridin-4-ylurea
CID 111112659
1-(3-aminophenyl)-3-(1-ethylpyrazol-4-yl)urea
CID 43543950
4-[(1-ethylpyrazol-4-yl)carbamoylamino]-3-methoxybutanoic acid
CID 103158622
1-(4-cyanophenyl)-3-[(1-hydroxycyclobutyl)methyl]urea
CID 115619734
1-(1-ethylpyrazol-4-yl)-3-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]urea
CID 94145583
2-[(1-ethylpyrazol-4-yl)carbamoylamino]-2-methylbutanoic acid
CID 79800954

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea?
The IUPAC name of 1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea (CID 146087715) is 1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea.
What is the SMILES notation for 1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea?
The canonical SMILES for 1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea is CCn1cc(NC(=O)NCC2(O)CCC2)cn1.
What is the InChIKey of 1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea?
The InChIKey is ODQIYOHBDIFJPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-2-15-7-9(6-13-15)14-10(16)12-8-11(17)4-3-5-11/h6-7,17H,2-5,8H2,1H3,(H2,12,14,16).
What are the key properties of 1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea?
1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea has a molecular weight of 238.29 g/mol, XLogP of 0.94, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylpyrazol-4-yl)-3-[(1-hydroxycyclobutyl)methyl]urea is sourced from PubChem (CID 146087715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).