1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea

C13H17N5O2 — CID 166315508

IUPAC1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea
SMILESCOCC1CC(NC(=O)Nc2cnn3cccnc23)C1
InChIInChI=1S/C13H17N5O2/c1-20-8-9-5-10(6-9)16-13(19)17-11-7-15-18-4-2-3-14-12(11)18/h2-4,7,9-10H,5-6,8H2,1H3,(H2,16,17,19)
InChIKeyCSWGJEYKHGYRBM-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.28
Rot. Bonds4

About 1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea

1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea (PubChem CID 166315508) has the molecular formula C13H17N5O2 and a molecular weight of 275.31 g/mol. Its IUPAC name is 1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea.

Molecular Properties

Compound Name1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea
PubChem CID166315508
Molecular FormulaC13H17N5O2
Molecular Weight275.31 g/mol
Exact Mass275.14
IUPAC Name1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea
SMILESCOCC1CC(NC(=O)Nc2cnn3cccnc23)C1
InChIInChI=1S/C13H17N5O2/c1-20-8-9-5-10(6-9)16-13(19)17-11-7-15-18-4-2-3-14-12(11)18/h2-4,7,9-10H,5-6,8H2,1H3,(H2,16,17,19)
InChIKeyCSWGJEYKHGYRBM-UHFFFAOYSA-N
XLogP1.28
TPSA80.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-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-(3,3-dimethyl-1,2-dihydroinden-1-yl)-3-pyrazolo[1,5-a]pyrimidin-3-ylurea
CID 166315512
4-ethoxy-N-pyrazolo[1,5-a]pyrimidin-3-yloxane-4-carboxamide
CID 166315563
[(2R)-1-[[4-[6-methoxy-5-(pyrazolo[1,5-a]pyrimidin-3-ylcarbamoyl)indazol-2-yl]cyclohexyl]methylamino]-1-oxopropan-2-yl] acetate
CID 163396260
6-methoxy-2-[(1S,2S)-2-methyl-4-(methylamino)cyclohexyl]-N-pyrazolo[1,5-a]pyrimidin-3-ylindazole-5-carboxamide
CID 163396571
N-(1,1-dioxothietan-3-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 166255196
2-[(1S,2S,4S)-4-[acetyl(methyl)amino]-2-methylcyclohexyl]-6-methoxy-N-pyrazolo[1,5-a]pyrimidin-3-ylindazole-5-carboxamide
CID 171034192
ethane;1-pyrazolo[1,5-a]pyrimidin-3-ylethanone
CID 91104664
4-amino-5-[(4-aminocyclohexyl)iminomethyl]-2-methoxy-N-pyrazolo[1,5-a]pyrimidin-3-ylbenzamide
CID 163396531
3-methoxy-4-(pyrazolo[1,5-a]pyrimidin-3-ylmethylamino)benzamide
CID 130350382
N-[6-(cyclopropylmethoxy)-2-methylindazol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 166536715
2-[(1R,3S)-3-hydroxy-3-methylcyclohexyl]-6-methoxy-N-pyrazolo[1,5-a]pyrimidin-3-ylindazole-5-carboxamide
CID 171034189
2-[(1S,3S)-3-hydroxy-3-methylcyclohexyl]-6-methoxy-N-pyrazolo[1,5-a]pyrimidin-3-ylindazole-5-carboxamide
CID 163396346

Frequently Asked Questions

What is the IUPAC name of 1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea?
The IUPAC name of 1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea (CID 166315508) is 1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea.
What is the SMILES notation for 1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea?
The canonical SMILES for 1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea is COCC1CC(NC(=O)Nc2cnn3cccnc23)C1.
What is the InChIKey of 1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea?
The InChIKey is CSWGJEYKHGYRBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O2/c1-20-8-9-5-10(6-9)16-13(19)17-11-7-15-18-4-2-3-14-12(11)18/h2-4,7,9-10H,5-6,8H2,1H3,(H2,16,17,19).
What are the key properties of 1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea?
1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea has a molecular weight of 275.31 g/mol, XLogP of 1.28, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(methoxymethyl)cyclobutyl]-3-pyrazolo[1,5-a]pyrimidin-3-ylurea is sourced from PubChem (CID 166315508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).