(2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide

C6H10N4O — CID 54458164

IUPAC(2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide
SMILESC[C@H](N)C(=O)Nc1ccn[nH]1
InChIInChI=1S/C6H10N4O/c1-4(7)6(11)9-5-2-3-8-10-5/h2-4H,7H2,1H3,(H2,8,9,10,11)/t4-/m0/s1
InChIKeyWZRDJZKSRUTLNY-BYPYZUCNSA-N
MW154.17 g/mol
LogP-0.30
Rot. Bonds2

About (2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide

(2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide (PubChem CID 54458164) has the molecular formula C6H10N4O and a molecular weight of 154.17 g/mol. Its IUPAC name is (2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide
PubChem CID54458164
Molecular FormulaC6H10N4O
Molecular Weight154.17 g/mol
Exact Mass154.09
IUPAC Name(2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide
SMILESC[C@H](N)C(=O)Nc1ccn[nH]1
InChIInChI=1S/C6H10N4O/c1-4(7)6(11)9-5-2-3-8-10-5/h2-4H,7H2,1H3,(H2,8,9,10,11)/t4-/m0/s1
InChIKeyWZRDJZKSRUTLNY-BYPYZUCNSA-N
XLogP-0.30
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-0.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide?
The IUPAC name of (2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide (CID 54458164) is (2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide.
What is the SMILES notation for (2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide?
The canonical SMILES for (2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide is C[C@H](N)C(=O)Nc1ccn[nH]1.
What is the InChIKey of (2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide?
The InChIKey is WZRDJZKSRUTLNY-BYPYZUCNSA-N. The full InChI is InChI=1S/C6H10N4O/c1-4(7)6(11)9-5-2-3-8-10-5/h2-4H,7H2,1H3,(H2,8,9,10,11)/t4-/m0/s1.
What are the key properties of (2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide?
(2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide has a molecular weight of 154.17 g/mol, XLogP of -0.30, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(1H-pyrazol-5-yl)propanamide is sourced from PubChem (CID 54458164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).