N-methyl-2-propan-2-ylpyrazol-3-amine

C7H13N3 — CID 63090550

IUPACN-methyl-2-propan-2-ylpyrazol-3-amine
SMILESCNc1ccnn1C(C)C
InChIInChI=1S/C7H13N3/c1-6(2)10-7(8-3)4-5-9-10/h4-6,8H,1-3H3
InChIKeyWTVUBTWCJKHMIW-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.51
Rot. Bonds2

About N-methyl-2-propan-2-ylpyrazol-3-amine

N-methyl-2-propan-2-ylpyrazol-3-amine (PubChem CID 63090550) has the molecular formula C7H13N3 and a molecular weight of 139.20 g/mol. Its IUPAC name is N-methyl-2-propan-2-ylpyrazol-3-amine.

Molecular Properties

Compound NameN-methyl-2-propan-2-ylpyrazol-3-amine
PubChem CID63090550
Molecular FormulaC7H13N3
Molecular Weight139.20 g/mol
Exact Mass139.11
IUPAC NameN-methyl-2-propan-2-ylpyrazol-3-amine
SMILESCNc1ccnn1C(C)C
InChIInChI=1S/C7H13N3/c1-6(2)10-7(8-3)4-5-9-10/h4-6,8H,1-3H3
InChIKeyWTVUBTWCJKHMIW-UHFFFAOYSA-N
XLogP1.51
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-propan-2-ylpyrazol-3-amine?
The IUPAC name of N-methyl-2-propan-2-ylpyrazol-3-amine (CID 63090550) is N-methyl-2-propan-2-ylpyrazol-3-amine.
What is the SMILES notation for N-methyl-2-propan-2-ylpyrazol-3-amine?
The canonical SMILES for N-methyl-2-propan-2-ylpyrazol-3-amine is CNc1ccnn1C(C)C.
What is the InChIKey of N-methyl-2-propan-2-ylpyrazol-3-amine?
The InChIKey is WTVUBTWCJKHMIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N3/c1-6(2)10-7(8-3)4-5-9-10/h4-6,8H,1-3H3.
What are the key properties of N-methyl-2-propan-2-ylpyrazol-3-amine?
N-methyl-2-propan-2-ylpyrazol-3-amine has a molecular weight of 139.20 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-propan-2-ylpyrazol-3-amine is sourced from PubChem (CID 63090550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).