3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine

C8H13N3O — CID 103079090

IUPAC3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine
SMILESCn1cc(N)c(OCC2CC2)n1
InChIInChI=1S/C8H13N3O/c1-11-4-7(9)8(10-11)12-5-6-2-3-6/h4,6H,2-3,5,9H2,1H3
InChIKeyKWOLHIBZOQSGAY-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.79
Rot. Bonds3

About 3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine

3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine (PubChem CID 103079090) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine.

Molecular Properties

Compound Name3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine
PubChem CID103079090
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine
SMILESCn1cc(N)c(OCC2CC2)n1
InChIInChI=1S/C8H13N3O/c1-11-4-7(9)8(10-11)12-5-6-2-3-6/h4,6H,2-3,5,9H2,1H3
InChIKeyKWOLHIBZOQSGAY-UHFFFAOYSA-N
XLogP0.79
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-3-(oxan-4-ylmethoxy)pyrazol-4-amine
CID 103079156
1-methyl-3-propoxypyrazol-4-amine;hydrochloride
CID 102565575
1-methyl-3-(2-piperidin-1-ylethoxy)pyrazol-4-amine
CID 103079138
3-(4,4-dimethylcyclohexyl)oxy-1-methylpyrazol-4-amine
CID 103079230
3-[(4-bromophenyl)methoxy]-1-methylpyrazol-4-amine
CID 103079210
5-(cyclopropylmethoxy)-1,3-dimethylpyrazol-4-amine
CID 43554459
4-(cyclopropylmethoxy)pyrimidin-5-amine
CID 79918233
6-(cyclopropylmethoxy)-2-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-2,5-diamine
CID 80684692
4-amino-N-[(4-hydroxycyclohexyl)methyl]-1-methylpyrazole-3-carboxamide
CID 106119084
6-(cyclopropylmethoxy)-2-N-[2-(1-methylpyrazol-4-yl)ethyl]pyridine-2,5-diamine
CID 80685641
3-butan-2-yloxy-1-methylpyrazol-4-amine
CID 103079130
4-(cyclopropylmethoxy)-2-methyl-5-[1-methyl-3-(trifluoromethyl)pyrazol-4-yl]pyrimidine
CID 144632594

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine?
The IUPAC name of 3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine (CID 103079090) is 3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine.
What is the SMILES notation for 3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine?
The canonical SMILES for 3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine is Cn1cc(N)c(OCC2CC2)n1.
What is the InChIKey of 3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine?
The InChIKey is KWOLHIBZOQSGAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-11-4-7(9)8(10-11)12-5-6-2-3-6/h4,6H,2-3,5,9H2,1H3.
What are the key properties of 3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine?
3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine has a molecular weight of 167.21 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylmethoxy)-1-methylpyrazol-4-amine is sourced from PubChem (CID 103079090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).