4-methyl-5-propan-2-yl-1H-pyrazol-3-amine

C7H13N3 — CID 15187834

IUPAC4-methyl-5-propan-2-yl-1H-pyrazol-3-amine
SMILESCc1c(N)n[nH]c1C(C)C
InChIInChI=1S/C7H13N3/c1-4(2)6-5(3)7(8)10-9-6/h4H,1-3H3,(H3,8,9,10)
InChIKeyYRHGBIXKWWOYPC-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.42
Rot. Bonds1

About 4-methyl-5-propan-2-yl-1H-pyrazol-3-amine

4-methyl-5-propan-2-yl-1H-pyrazol-3-amine (PubChem CID 15187834) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is 4-methyl-5-propan-2-yl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name4-methyl-5-propan-2-yl-1H-pyrazol-3-amine
PubChem CID15187834
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC Name4-methyl-5-propan-2-yl-1H-pyrazol-3-amine
SMILESCc1c(N)n[nH]c1C(C)C
InChIInChI=1S/C7H13N3/c1-4(2)6-5(3)7(8)10-9-6/h4H,1-3H3,(H3,8,9,10)
InChIKeyYRHGBIXKWWOYPC-UHFFFAOYSA-N
XLogP1.42
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-propan-2-yl-1H-pyrazol-3-amine?
The IUPAC name of 4-methyl-5-propan-2-yl-1H-pyrazol-3-amine (CID 15187834) is 4-methyl-5-propan-2-yl-1H-pyrazol-3-amine.
What is the SMILES notation for 4-methyl-5-propan-2-yl-1H-pyrazol-3-amine?
The canonical SMILES for 4-methyl-5-propan-2-yl-1H-pyrazol-3-amine is Cc1c(N)n[nH]c1C(C)C.
What is the InChIKey of 4-methyl-5-propan-2-yl-1H-pyrazol-3-amine?
The InChIKey is YRHGBIXKWWOYPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3/c1-4(2)6-5(3)7(8)10-9-6/h4H,1-3H3,(H3,8,9,10).
What are the key properties of 4-methyl-5-propan-2-yl-1H-pyrazol-3-amine?
4-methyl-5-propan-2-yl-1H-pyrazol-3-amine has a molecular weight of 139.20 g/mol, XLogP of 1.42, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-propan-2-yl-1H-pyrazol-3-amine is sourced from PubChem (CID 15187834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).