N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine

C10H19N3O — CID 115922045

IUPACN-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine
SMILESCOC(C)C(C)Nc1cc(C)n(C)n1
InChIInChI=1S/C10H19N3O/c1-7-6-10(12-13(7)4)11-8(2)9(3)14-5/h6,8-9H,1-5H3,(H,11,12)
InChIKeyPKHSJFAESBGWDI-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.56
Rot. Bonds4

About N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine

N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine (PubChem CID 115922045) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine.

Molecular Properties

Compound NameN-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine
PubChem CID115922045
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC NameN-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine
SMILESCOC(C)C(C)Nc1cc(C)n(C)n1
InChIInChI=1S/C10H19N3O/c1-7-6-10(12-13(7)4)11-8(2)9(3)14-5/h6,8-9H,1-5H3,(H,11,12)
InChIKeyPKHSJFAESBGWDI-UHFFFAOYSA-N
XLogP1.56
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(1,5-dimethylpyrazol-3-yl)amino]propan-1-ol
CID 130502735
N-(1-cyclobutylethyl)-1,5-dimethylpyrazol-3-amine
CID 130607965
N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-4-amine
CID 115923272
N-heptan-4-yl-1,5-dimethylpyrazol-3-amine
CID 115922057
1,5-dimethyl-N-[1-(5-methylfuran-2-yl)ethyl]pyrazol-3-amine
CID 115922058
N-(3-methoxybutan-2-yl)-1,3-dimethylpyrazol-4-amine
CID 104955905
N-hex-5-en-2-yl-1,5-dimethylpyrazol-3-amine
CID 104583972
1,5-dimethyl-N-(1-thiophen-2-ylethyl)pyrazol-3-amine
CID 115922060
1,5-dimethyl-N-[1-(1,3-thiazol-5-yl)ethyl]pyrazol-3-amine
CID 115922073
2-[5-(3-methoxybutan-2-ylamino)-3-methylpyrazol-1-yl]ethanol
CID 115925988
N-[1-(3-fluorophenyl)ethyl]-1,5-dimethylpyrazol-3-amine
CID 113287971
(2R)-1-N-(1,5-dimethylpyrazol-3-yl)-3-methylbutane-1,2-diamine
CID 130523879

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine?
The IUPAC name of N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine (CID 115922045) is N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine.
What is the SMILES notation for N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine?
The canonical SMILES for N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine is COC(C)C(C)Nc1cc(C)n(C)n1.
What is the InChIKey of N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine?
The InChIKey is PKHSJFAESBGWDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-7-6-10(12-13(7)4)11-8(2)9(3)14-5/h6,8-9H,1-5H3,(H,11,12).
What are the key properties of N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine?
N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine has a molecular weight of 197.28 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxybutan-2-yl)-1,5-dimethylpyrazol-3-amine is sourced from PubChem (CID 115922045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).