5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine

C11H21N3 — CID 115921324

IUPAC5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine
SMILESCCc1[nH]nc(NC(C)C(C)C)c1C
InChIInChI=1S/C11H21N3/c1-6-10-8(4)11(14-13-10)12-9(5)7(2)3/h7,9H,6H2,1-5H3,(H2,12,13,14)
InChIKeyWTPIOLRUDAGYBR-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.74
Rot. Bonds4

About 5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine

5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine (PubChem CID 115921324) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is 5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine
PubChem CID115921324
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine
SMILESCCc1[nH]nc(NC(C)C(C)C)c1C
InChIInChI=1S/C11H21N3/c1-6-10-8(4)11(14-13-10)12-9(5)7(2)3/h7,9H,6H2,1-5H3,(H2,12,13,14)
InChIKeyWTPIOLRUDAGYBR-UHFFFAOYSA-N
XLogP2.74
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-4-methyl-N-pentan-2-yl-1H-pyrazol-3-amine
CID 115921318
N-(1-cyclopropyl-2-methylpropyl)-5-ethyl-4-methyl-1H-pyrazol-3-amine
CID 115921342
5-ethyl-N-(2-ethylbutyl)-4-methyl-1H-pyrazol-3-amine
CID 115757165
5-ethyl-N-(furan-3-ylmethyl)-4-methyl-1H-pyrazol-3-amine
CID 115735786
5-ethyl-4-methyl-N-(oxan-4-yl)-1H-pyrazol-3-amine
CID 115735766
5-ethyl-4-methyl-N-(1H-pyrrol-3-ylmethyl)-1H-pyrazol-3-amine
CID 115735771
5-ethyl-4-methyl-N-pyrrolidin-3-yl-1H-pyrazol-3-amine
CID 114697915
1-(5-ethyl-4-methyl-1H-pyrazol-3-yl)-3-(2,2,2-trifluoroethyl)urea
CID 56786023
5-ethyl-4-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-1H-pyrazol-3-amine
CID 115735773
5-ethyl-4-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]-1H-pyrazol-3-amine
CID 71914474
5-ethyl-4-methyl-N-[(1-methylpyrrol-2-yl)methyl]-1H-pyrazol-3-amine
CID 115735769
N-(5-ethyl-4-methyl-1H-pyrazol-3-yl)-2,6-difluorobenzamide
CID 155945536

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine?
The IUPAC name of 5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine (CID 115921324) is 5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine is CCc1[nH]nc(NC(C)C(C)C)c1C.
What is the InChIKey of 5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine?
The InChIKey is WTPIOLRUDAGYBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3/c1-6-10-8(4)11(14-13-10)12-9(5)7(2)3/h7,9H,6H2,1-5H3,(H2,12,13,14).
What are the key properties of 5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine?
5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine has a molecular weight of 195.31 g/mol, XLogP of 2.74, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-methyl-N-(3-methylbutan-2-yl)-1H-pyrazol-3-amine is sourced from PubChem (CID 115921324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).