5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine

C10H16ClN3 — CID 164658719

IUPAC5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine
SMILESCC1CC(Nc2cnn(C)c2Cl)C1C
InChIInChI=1S/C10H16ClN3/c1-6-4-8(7(6)2)13-9-5-12-14(3)10(9)11/h5-8,13H,4H2,1-3H3
InChIKeyQRHSRYZEZXQUQI-UHFFFAOYSA-N
MW213.71 g/mol
LogP2.53
Rot. Bonds2

About 5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine

5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine (PubChem CID 164658719) has the molecular formula C10H16ClN3 and a molecular weight of 213.71 g/mol. Its IUPAC name is 5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine.

Molecular Properties

Compound Name5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine
PubChem CID164658719
Molecular FormulaC10H16ClN3
Molecular Weight213.71 g/mol
Exact Mass213.10
IUPAC Name5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine
SMILESCC1CC(Nc2cnn(C)c2Cl)C1C
InChIInChI=1S/C10H16ClN3/c1-6-4-8(7(6)2)13-9-5-12-14(3)10(9)11/h5-8,13H,4H2,1-3H3
InChIKeyQRHSRYZEZXQUQI-UHFFFAOYSA-N
XLogP2.53
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.71
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5-chloro-1-methylpyrazol-4-yl)amino]cyclopentan-1-ol
CID 164649883
3,6-dichloro-N-(2,3-dimethylcyclobutyl)pyridazin-4-amine
CID 130905616
4-chloro-2-methyl-5-[(2-methylcyclopentyl)amino]pyridazin-3-one
CID 115613233
N-(2,3-dimethylcyclobutyl)-4-methylthiophen-3-amine
CID 130735161
5-ethyl-1-methyl-N-(2-methylcyclobutyl)pyrazol-4-amine
CID 130617239
2-butyl-4-chloro-5-[(2-methylcyclopropyl)amino]pyridazin-3-one
CID 114437041
2-[(5-chloro-1-methylpyrazol-4-yl)amino]-N-methylacetamide
CID 164649869
4-chloro-5-[(2,3-dimethylcyclopentyl)amino]-2-ethylpyridazin-3-one
CID 114439119
4-chloro-5-[(2,3-dimethylcyclopentyl)amino]-2-propan-2-ylpyridazin-3-one
CID 114439128
4-chloro-5-[(2-hydroxycyclohexyl)amino]-2-methylpyridazin-3-one
CID 115611062
2-bromo-N-(5-chloro-1-methylpyrazol-4-yl)-2-methylpropanamide
CID 164658758
1-methyl-N-(2-methylcyclopropyl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 62397166

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine?
The IUPAC name of 5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine (CID 164658719) is 5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine.
What is the SMILES notation for 5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine?
The canonical SMILES for 5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine is CC1CC(Nc2cnn(C)c2Cl)C1C.
What is the InChIKey of 5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine?
The InChIKey is QRHSRYZEZXQUQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16ClN3/c1-6-4-8(7(6)2)13-9-5-12-14(3)10(9)11/h5-8,13H,4H2,1-3H3.
What are the key properties of 5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine?
5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine has a molecular weight of 213.71 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,3-dimethylcyclobutyl)-1-methylpyrazol-4-amine is sourced from PubChem (CID 164658719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).