(2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide

C11H20N4O — CID 103794002

IUPAC(2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide
SMILESCCC[C@@H](N)C(=O)Nc1ccnn1C(C)C
InChIInChI=1S/C11H20N4O/c1-4-5-9(12)11(16)14-10-6-7-13-15(10)8(2)3/h6-9H,4-5,12H2,1-3H3,(H,14,16)/t9-/m1/s1
InChIKeyBLYQICGXNXEDCF-SECBINFHSA-N
MW224.31 g/mol
LogP1.53
Rot. Bonds5

About (2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide

(2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide (PubChem CID 103794002) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is (2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide
PubChem CID103794002
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name(2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide
SMILESCCC[C@@H](N)C(=O)Nc1ccnn1C(C)C
InChIInChI=1S/C11H20N4O/c1-4-5-9(12)11(16)14-10-6-7-13-15(10)8(2)3/h6-9H,4-5,12H2,1-3H3,(H,14,16)/t9-/m1/s1
InChIKeyBLYQICGXNXEDCF-SECBINFHSA-N
XLogP1.53
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(ethylamino)-2-methyl-N-(2-propan-2-ylpyrazol-3-yl)propanamide
CID 62853946
2-amino-N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)pentanamide
CID 54863652
(2R)-2-amino-N-[4-(triazol-2-yl)phenyl]pentanamide
CID 103795568
1-O-ethyl 4-O-[1-oxo-1-[(2-propan-2-ylpyrazol-3-yl)amino]propan-2-yl] (E)-but-2-enedioate
CID 42902059
methyl N-(2-propan-2-ylpyrazol-3-yl)carbamate
CID 115619372
(2S)-2-amino-N-(3-hydroxy-2-pyridinyl)pentanamide
CID 107570512
4-amino-N-(2-propan-2-ylpyrazol-3-yl)butanamide
CID 71668599
benzyl N-(2-propan-2-ylpyrazol-3-yl)carbamate
CID 130581119
2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]hexanamide
CID 165484923
2-(azepan-1-yl)-N-(2-propan-2-ylpyrazol-3-yl)propanamide
CID 42913354
(2R)-2-amino-N-(3-methyl-2-pyridinyl)pentanamide
CID 107568105
(2S)-2-benzylsulfonyl-N-(2-propan-2-ylpyrazol-3-yl)propanamide
CID 99841181

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide?
The IUPAC name of (2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide (CID 103794002) is (2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide.
What is the SMILES notation for (2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide?
The canonical SMILES for (2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide is CCC[C@@H](N)C(=O)Nc1ccnn1C(C)C.
What is the InChIKey of (2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide?
The InChIKey is BLYQICGXNXEDCF-SECBINFHSA-N. The full InChI is InChI=1S/C11H20N4O/c1-4-5-9(12)11(16)14-10-6-7-13-15(10)8(2)3/h6-9H,4-5,12H2,1-3H3,(H,14,16)/t9-/m1/s1.
What are the key properties of (2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide?
(2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide has a molecular weight of 224.31 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(2-propan-2-ylpyrazol-3-yl)pentanamide is sourced from PubChem (CID 103794002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).