cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine

C9H15N3O — CID 114646874

IUPACcyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine
SMILESCOc1cnn(C)c1C(N)C1CC1
InChIInChI=1S/C9H15N3O/c1-12-9(7(13-2)5-11-12)8(10)6-3-4-6/h5-6,8H,3-4,10H2,1-2H3
InChIKeyWQNCZLRQGGKWKR-UHFFFAOYSA-N
MW181.24 g/mol
LogP0.84
Rot. Bonds3

About cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine

cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine (PubChem CID 114646874) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine.

Molecular Properties

Compound Namecyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine
PubChem CID114646874
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Namecyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine
SMILESCOc1cnn(C)c1C(N)C1CC1
InChIInChI=1S/C9H15N3O/c1-12-9(7(13-2)5-11-12)8(10)6-3-4-6/h5-6,8H,3-4,10H2,1-2H3
InChIKeyWQNCZLRQGGKWKR-UHFFFAOYSA-N
XLogP0.84
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-ethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 114655202
2-cyclohexyl-2-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)ethanamine
CID 114662095
[(4-tert-butylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105232753
[(4,4-dimethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105231780
(4,4-difluorocyclohexyl)-(4-methoxy-1-propylpyrazol-5-yl)methanamine
CID 105187165
2,3-dihydro-1-benzofuran-3-yl-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 114659976
1-(4-methoxy-1-methylpyrazol-5-yl)-2-methylbutan-1-amine
CID 114651682
(1-methoxy-4,4-dimethylcyclohexyl)-(4-methoxy-1-methylpyrazol-5-yl)methanamine
CID 114662029
1-(4-methoxy-1-methylpyrazol-5-yl)ethylhydrazine
CID 105201324
[6-bicyclo[3.1.0]hexanyl-(4-methoxy-1-methylpyrazol-5-yl)methyl]hydrazine
CID 105339126
(4-methoxy-1-methylpyrazol-5-yl)-(2,3,4,5,6-pentafluorophenyl)methanamine
CID 105046927
(4-bromo-1-methylpyrazol-5-yl)-cyclohexylmethanamine
CID 114646840

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine?
The IUPAC name of cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine (CID 114646874) is cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine.
What is the SMILES notation for cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine?
The canonical SMILES for cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine is COc1cnn(C)c1C(N)C1CC1.
What is the InChIKey of cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine?
The InChIKey is WQNCZLRQGGKWKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-12-9(7(13-2)5-11-12)8(10)6-3-4-6/h5-6,8H,3-4,10H2,1-2H3.
What are the key properties of cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine?
cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine has a molecular weight of 181.24 g/mol, XLogP of 0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(4-methoxy-1-methylpyrazol-5-yl)methanamine is sourced from PubChem (CID 114646874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).