2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide

C11H20N4O — CID 43547722

IUPAC2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide
SMILESCc1n[nH]c(C)c1NC(=O)C(N)CC(C)C
InChIInChI=1S/C11H20N4O/c1-6(2)5-9(12)11(16)13-10-7(3)14-15-8(10)4/h6,9H,5,12H2,1-4H3,(H,13,16)(H,14,15)
InChIKeyOUXJXKCOPDSPQN-UHFFFAOYSA-N
MW224.31 g/mol
LogP1.34
Rot. Bonds4

About 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide

2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide (PubChem CID 43547722) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide
PubChem CID43547722
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide
SMILESCc1n[nH]c(C)c1NC(=O)C(N)CC(C)C
InChIInChI=1S/C11H20N4O/c1-6(2)5-9(12)11(16)13-10-7(3)14-15-8(10)4/h6,9H,5,12H2,1-4H3,(H,13,16)(H,14,15)
InChIKeyOUXJXKCOPDSPQN-UHFFFAOYSA-N
XLogP1.34
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide?
The IUPAC name of 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide (CID 43547722) is 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide.
What is the SMILES notation for 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide?
The canonical SMILES for 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide is Cc1n[nH]c(C)c1NC(=O)C(N)CC(C)C.
What is the InChIKey of 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide?
The InChIKey is OUXJXKCOPDSPQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-6(2)5-9(12)11(16)13-10-7(3)14-15-8(10)4/h6,9H,5,12H2,1-4H3,(H,13,16)(H,14,15).
What are the key properties of 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide?
2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide has a molecular weight of 224.31 g/mol, XLogP of 1.34, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3,5-dimethyl-1H-pyrazol-4-yl)-4-methylpentanamide is sourced from PubChem (CID 43547722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).