2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide

C14H26N4O — CID 54863689

IUPAC2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)Nc1c(C)nn(C(C)C)c1C
InChIInChI=1S/C14H26N4O/c1-7-8-14(6,15)13(19)16-12-10(4)17-18(9(2)3)11(12)5/h9H,7-8,15H2,1-6H3,(H,16,19)
InChIKeySLDHHIRDBUZCMF-UHFFFAOYSA-N
MW266.39 g/mol
LogP2.54
Rot. Bonds5

About 2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide

2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide (PubChem CID 54863689) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide
PubChem CID54863689
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)Nc1c(C)nn(C(C)C)c1C
InChIInChI=1S/C14H26N4O/c1-7-8-14(6,15)13(19)16-12-10(4)17-18(9(2)3)11(12)5/h9H,7-8,15H2,1-6H3,(H,16,19)
InChIKeySLDHHIRDBUZCMF-UHFFFAOYSA-N
XLogP2.54
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide?
The IUPAC name of 2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide (CID 54863689) is 2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide.
What is the SMILES notation for 2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide?
The canonical SMILES for 2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide is CCCC(C)(N)C(=O)Nc1c(C)nn(C(C)C)c1C.
What is the InChIKey of 2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide?
The InChIKey is SLDHHIRDBUZCMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-7-8-14(6,15)13(19)16-12-10(4)17-18(9(2)3)11(12)5/h9H,7-8,15H2,1-6H3,(H,16,19).
What are the key properties of 2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide?
2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide has a molecular weight of 266.39 g/mol, XLogP of 2.54, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-methylpentanamide is sourced from PubChem (CID 54863689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).