3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine

C8H15N3O — CID 169237600

IUPAC3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine
SMILESCCOc1cc(NC(C)C)[nH]n1
InChIInChI=1S/C8H15N3O/c1-4-12-8-5-7(10-11-8)9-6(2)3/h5-6H,4H2,1-3H3,(H2,9,10,11)
InChIKeyFQOVYMKCLLPAIB-UHFFFAOYSA-N
MW169.23 g/mol
LogP1.63
Rot. Bonds4

About 3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine

3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine (PubChem CID 169237600) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is 3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine.

Molecular Properties

Compound Name3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine
PubChem CID169237600
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine
SMILESCCOc1cc(NC(C)C)[nH]n1
InChIInChI=1S/C8H15N3O/c1-4-12-8-5-7(10-11-8)9-6(2)3/h5-6H,4H2,1-3H3,(H2,9,10,11)
InChIKeyFQOVYMKCLLPAIB-UHFFFAOYSA-N
XLogP1.63
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethoxy-5-methyl-1H-pyrazole;hydrochloride
CID 53398899
2-chloro-6-[(3-ethoxy-1H-pyrazol-5-yl)amino]-4-methylpyridine-3-carbonitrile
CID 11983604
(2R)-2-[[5-chloro-4-[(3-ethoxy-1H-pyrazol-5-yl)amino]pyrimidin-2-yl]amino]-2-(4-fluorophenyl)ethanol
CID 68898915
3-ethoxy-N-[2-(4-fluorophenyl)propyl]-1H-pyrazole-5-carboxamide
CID 110279600
5-butan-2-yl-N-propan-2-yl-1H-pyrazol-3-amine
CID 63047816
6-ethoxy-N-(4-methylhexan-2-yl)pyrimidin-4-amine
CID 66328442
6-ethoxy-N-(3-methylpentan-2-yl)pyrimidin-4-amine
CID 66330763
6-ethoxy-2-methyl-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyrimidin-4-amine
CID 106282952
(2R)-2-[[6-[(3-ethoxy-1H-pyrazol-5-yl)amino]-5-nitro-2-pyridinyl]amino]-2-(5-fluoro-2-pyridinyl)ethanol
CID 68736639
5-chloro-2-ethoxy-N-(3-methylpentan-2-yl)aniline
CID 63451120
N-(2-chloropropyl)-4-ethoxy-6-methylpyrimidin-2-amine
CID 112635580
N-(1-chloropropan-2-yl)-4-ethoxypyrimidin-2-amine
CID 112639273

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine?
The IUPAC name of 3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine (CID 169237600) is 3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine.
What is the SMILES notation for 3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine?
The canonical SMILES for 3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine is CCOc1cc(NC(C)C)[nH]n1.
What is the InChIKey of 3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine?
The InChIKey is FQOVYMKCLLPAIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-4-12-8-5-7(10-11-8)9-6(2)3/h5-6H,4H2,1-3H3,(H2,9,10,11).
What are the key properties of 3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine?
3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine has a molecular weight of 169.23 g/mol, XLogP of 1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-propan-2-yl-1H-pyrazol-5-amine is sourced from PubChem (CID 169237600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).