(2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide

C14H26N4O — CID 56861577

IUPAC(2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide
SMILESCC(C)C[C@@H](N)C(=O)N(Cc1cnn(C)c1)C(C)C
InChIInChI=1S/C14H26N4O/c1-10(2)6-13(15)14(19)18(11(3)4)9-12-7-16-17(5)8-12/h7-8,10-11,13H,6,9,15H2,1-5H3/t13-/m1/s1
InChIKeyVSXWLEZUGKPOGU-CYBMUJFWSA-N
MW266.39 g/mol
LogP1.53
Rot. Bonds6

About (2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide

(2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide (PubChem CID 56861577) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is (2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide.

Molecular Properties

Compound Name(2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide
PubChem CID56861577
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name(2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide
SMILESCC(C)C[C@@H](N)C(=O)N(Cc1cnn(C)c1)C(C)C
InChIInChI=1S/C14H26N4O/c1-10(2)6-13(15)14(19)18(11(3)4)9-12-7-16-17(5)8-12/h7-8,10-11,13H,6,9,15H2,1-5H3/t13-/m1/s1
InChIKeyVSXWLEZUGKPOGU-CYBMUJFWSA-N
XLogP1.53
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide?
The IUPAC name of (2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide (CID 56861577) is (2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide.
What is the SMILES notation for (2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide?
The canonical SMILES for (2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide is CC(C)C[C@@H](N)C(=O)N(Cc1cnn(C)c1)C(C)C.
What is the InChIKey of (2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide?
The InChIKey is VSXWLEZUGKPOGU-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H26N4O/c1-10(2)6-13(15)14(19)18(11(3)4)9-12-7-16-17(5)8-12/h7-8,10-11,13H,6,9,15H2,1-5H3/t13-/m1/s1.
What are the key properties of (2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide?
(2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide has a molecular weight of 266.39 g/mol, XLogP of 1.53, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-4-methyl-N-[(1-methylpyrazol-4-yl)methyl]-N-propan-2-ylpentanamide is sourced from PubChem (CID 56861577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).