(2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide

C9H16N4O — CID 83618000

IUPAC(2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide
SMILESCC(C)C[C@@H](N)C(=O)Nc1cn[nH]c1
InChIInChI=1S/C9H16N4O/c1-6(2)3-8(10)9(14)13-7-4-11-12-5-7/h4-6,8H,3,10H2,1-2H3,(H,11,12)(H,13,14)/t8-/m1/s1
InChIKeyALGKOHNGIBYOCC-MRVPVSSYSA-N
MW196.25 g/mol
LogP0.72
Rot. Bonds4

About (2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide

(2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide (PubChem CID 83618000) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is (2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide
PubChem CID83618000
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name(2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide
SMILESCC(C)C[C@@H](N)C(=O)Nc1cn[nH]c1
InChIInChI=1S/C9H16N4O/c1-6(2)3-8(10)9(14)13-7-4-11-12-5-7/h4-6,8H,3,10H2,1-2H3,(H,11,12)(H,13,14)/t8-/m1/s1
InChIKeyALGKOHNGIBYOCC-MRVPVSSYSA-N
XLogP0.72
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.72
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(1H-pyrazol-4-yl)propanamide
CID 43540259
2-amino-3-methyl-N-(1H-pyrazol-4-yl)butanamide
CID 43540260
(2S)-2-amino-4-methyl-N-pyrimidin-5-ylpentanamide
CID 107588618
(2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide
CID 94893498
4-methyl-2-(1H-pyrazol-4-ylcarbamoylamino)pentanoic acid
CID 61209823
(2R)-2-amino-4-methyl-N-(1-methylpyrazol-4-yl)pentanamide
CID 93104460
2-amino-N-(1H-indazol-5-yl)-4-methylpentanamide
CID 43704662
2-amino-N-(4-hydroxyphenyl)-4-methylpentanamide
CID 22768242
(2S)-2-amino-4-methyl-N-(1,3,4-thiadiazol-2-yl)pentanamide
CID 13145508
2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide
CID 79506371
(2S)-2-amino-4-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]pentanamide
CID 61179187
2-amino-4-methyl-N-(4-propan-2-ylphenyl)pentanamide
CID 24696711

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide?
The IUPAC name of (2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide (CID 83618000) is (2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide.
What is the SMILES notation for (2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide?
The canonical SMILES for (2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide is CC(C)C[C@@H](N)C(=O)Nc1cn[nH]c1.
What is the InChIKey of (2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide?
The InChIKey is ALGKOHNGIBYOCC-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H16N4O/c1-6(2)3-8(10)9(14)13-7-4-11-12-5-7/h4-6,8H,3,10H2,1-2H3,(H,11,12)(H,13,14)/t8-/m1/s1.
What are the key properties of (2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide?
(2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide has a molecular weight of 196.25 g/mol, XLogP of 0.72, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide is sourced from PubChem (CID 83618000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).