1-ethyl-N-(2-methylpentyl)pyrazol-4-amine

C11H21N3 — CID 43543330

IUPAC1-ethyl-N-(2-methylpentyl)pyrazol-4-amine
SMILESCCCC(C)CNc1cnn(CC)c1
InChIInChI=1S/C11H21N3/c1-4-6-10(3)7-12-11-8-13-14(5-2)9-11/h8-10,12H,4-7H2,1-3H3
InChIKeyCPUKJORJOAUFPL-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.75
Rot. Bonds6

About 1-ethyl-N-(2-methylpentyl)pyrazol-4-amine

1-ethyl-N-(2-methylpentyl)pyrazol-4-amine (PubChem CID 43543330) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 1-ethyl-N-(2-methylpentyl)pyrazol-4-amine.

Molecular Properties

Compound Name1-ethyl-N-(2-methylpentyl)pyrazol-4-amine
PubChem CID43543330
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name1-ethyl-N-(2-methylpentyl)pyrazol-4-amine
SMILESCCCC(C)CNc1cnn(CC)c1
InChIInChI=1S/C11H21N3/c1-4-6-10(3)7-12-11-8-13-14(5-2)9-11/h8-10,12H,4-7H2,1-3H3
InChIKeyCPUKJORJOAUFPL-UHFFFAOYSA-N
XLogP2.75
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,1-diethylpyrazol-4-amine
CID 43543394
N-(3,3-dimethylbutan-2-yl)-1-ethylpyrazol-4-amine
CID 115922661
6-methyl-N-[(2R)-2-methylpentyl]pyridin-3-amine
CID 96903071
1-ethyl-N-(1-phenylbutyl)pyrazol-4-amine
CID 43543366
1-ethyl-N-[(1-propylpyrazol-4-yl)methyl]pyrazol-4-amine;hydrochloride
CID 126964986
N-tert-butyl-3-(1-ethylpyrazol-4-yl)-2-methylpropan-1-amine
CID 62530899
N-pentan-2-yl-1-propylpyrazol-4-amine
CID 115921377
1-ethyl-N-(4-methoxy-4-methylpentan-2-yl)pyrazol-4-amine
CID 43543286
2-[4-(2-methylpropylamino)pyrazol-1-yl]ethanol;hydrochloride
CID 126964216
3-(1-ethylpyrazol-4-yl)-2-methyl-N-propan-2-ylpropan-1-amine
CID 62529282
1-ethyl-N-[(5-methyl-2-propylpyrazol-3-yl)methyl]pyrazol-4-amine
CID 122167464
N-(2-methylpentyl)-4-pyrazol-1-ylaniline
CID 43688134

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(2-methylpentyl)pyrazol-4-amine?
The IUPAC name of 1-ethyl-N-(2-methylpentyl)pyrazol-4-amine (CID 43543330) is 1-ethyl-N-(2-methylpentyl)pyrazol-4-amine.
What is the SMILES notation for 1-ethyl-N-(2-methylpentyl)pyrazol-4-amine?
The canonical SMILES for 1-ethyl-N-(2-methylpentyl)pyrazol-4-amine is CCCC(C)CNc1cnn(CC)c1.
What is the InChIKey of 1-ethyl-N-(2-methylpentyl)pyrazol-4-amine?
The InChIKey is CPUKJORJOAUFPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-4-6-10(3)7-12-11-8-13-14(5-2)9-11/h8-10,12H,4-7H2,1-3H3.
What are the key properties of 1-ethyl-N-(2-methylpentyl)pyrazol-4-amine?
1-ethyl-N-(2-methylpentyl)pyrazol-4-amine has a molecular weight of 195.31 g/mol, XLogP of 2.75, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(2-methylpentyl)pyrazol-4-amine is sourced from PubChem (CID 43543330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).