2-(5-amino-1-phenylpyrazol-3-yl)acetamide

C11H12N4O — CID 118392815

IUPAC2-(5-amino-1-phenylpyrazol-3-yl)acetamide
SMILESNC(=O)Cc1cc(N)n(-c2ccccc2)n1
InChIInChI=1S/C11H12N4O/c12-10-6-8(7-11(13)16)14-15(10)9-4-2-1-3-5-9/h1-6H,7,12H2,(H2,13,16)
InChIKeyHLPBMIWOBYCPMN-UHFFFAOYSA-N
MW216.24 g/mol
LogP0.48
Rot. Bonds3

About 2-(5-amino-1-phenylpyrazol-3-yl)acetamide

2-(5-amino-1-phenylpyrazol-3-yl)acetamide (PubChem CID 118392815) has the molecular formula C11H12N4O and a molecular weight of 216.24 g/mol. Its IUPAC name is 2-(5-amino-1-phenylpyrazol-3-yl)acetamide.

Molecular Properties

Compound Name2-(5-amino-1-phenylpyrazol-3-yl)acetamide
PubChem CID118392815
Molecular FormulaC11H12N4O
Molecular Weight216.24 g/mol
Exact Mass216.10
IUPAC Name2-(5-amino-1-phenylpyrazol-3-yl)acetamide
SMILESNC(=O)Cc1cc(N)n(-c2ccccc2)n1
InChIInChI=1S/C11H12N4O/c12-10-6-8(7-11(13)16)14-15(10)9-4-2-1-3-5-9/h1-6H,7,12H2,(H2,13,16)
InChIKeyHLPBMIWOBYCPMN-UHFFFAOYSA-N
XLogP0.48
TPSA86.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-(5-amino-3-butylpyrazol-1-yl)phenyl]acetamide
CID 143256407
2-amino-N-[3-(5-amino-1-phenylpyrazol-3-yl)propyl]acetamide;dihydrochloride
CID 119890560
3-heptyl-1-phenylpyrazol-5-amine
CID 43336725
(2S)-2-amino-N-[3-(5-amino-1-phenylpyrazol-3-yl)propyl]-3-methylbutanamide
CID 119890553
ethyl 5-amino-1-phenylpyrazole-3-carboxylate
CID 23630921
(2S)-2-amino-N-[3-(5-amino-1-phenylpyrazol-3-yl)propyl]-3-methylbutanamide;dihydrochloride
CID 119890552
N-[3-(5-amino-1-phenylpyrazol-3-yl)propyl]-2-methyl-3-(methylamino)propanamide
CID 119890557
1-amino-N-[3-(5-amino-1-phenylpyrazol-3-yl)propyl]cyclopentane-1-carboxamide
CID 119890537
N-[3-(5-amino-1-phenylpyrazol-3-yl)propyl]-4-(methylamino)butanamide
CID 119890521
3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine
CID 82171782
3-[5-amino-3-(aminomethyl)pyrazol-1-yl]phenol
CID 83864512
4-amino-N-[3-(5-amino-1-phenylpyrazol-3-yl)propyl]pentanamide;dihydrochloride
CID 120565710

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-1-phenylpyrazol-3-yl)acetamide?
The IUPAC name of 2-(5-amino-1-phenylpyrazol-3-yl)acetamide (CID 118392815) is 2-(5-amino-1-phenylpyrazol-3-yl)acetamide.
What is the SMILES notation for 2-(5-amino-1-phenylpyrazol-3-yl)acetamide?
The canonical SMILES for 2-(5-amino-1-phenylpyrazol-3-yl)acetamide is NC(=O)Cc1cc(N)n(-c2ccccc2)n1.
What is the InChIKey of 2-(5-amino-1-phenylpyrazol-3-yl)acetamide?
The InChIKey is HLPBMIWOBYCPMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O/c12-10-6-8(7-11(13)16)14-15(10)9-4-2-1-3-5-9/h1-6H,7,12H2,(H2,13,16).
What are the key properties of 2-(5-amino-1-phenylpyrazol-3-yl)acetamide?
2-(5-amino-1-phenylpyrazol-3-yl)acetamide has a molecular weight of 216.24 g/mol, XLogP of 0.48, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-1-phenylpyrazol-3-yl)acetamide is sourced from PubChem (CID 118392815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).