2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide

C15H20N4O — CID 47842566

IUPAC2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide
SMILESCC(C)(C)NCC(=O)Nc1cccc(-c2ccn[nH]2)c1
InChIInChI=1S/C15H20N4O/c1-15(2,3)16-10-14(20)18-12-6-4-5-11(9-12)13-7-8-17-19-13/h4-9,16H,10H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyBEVDYAOOJUJBSP-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.40
Rot. Bonds4

About 2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide

2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide (PubChem CID 47842566) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide
PubChem CID47842566
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide
SMILESCC(C)(C)NCC(=O)Nc1cccc(-c2ccn[nH]2)c1
InChIInChI=1S/C15H20N4O/c1-15(2,3)16-10-14(20)18-12-6-4-5-11(9-12)13-7-8-17-19-13/h4-9,16H,10H2,1-3H3,(H,17,19)(H,18,20)
InChIKeyBEVDYAOOJUJBSP-UHFFFAOYSA-N
XLogP2.40
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-methylpropan-2-yl)oxy]-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide
CID 115949454
2-(prop-2-enylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide
CID 79285096
N'-tert-butyl-N-[3-(1H-pyrazol-5-yl)phenyl]ethane-1,2-diamine
CID 107445250
2-cyclopropyl-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide
CID 37044565
N-tert-butyl-3-(1H-pyrazol-5-yl)aniline
CID 58709859
1-phenyl-3-[3-(1H-pyrazol-5-yl)phenyl]urea
CID 60969581
2-(4-ethoxyphenoxy)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide
CID 38808558
N-(3-acetylphenyl)-2-(tert-butylamino)acetamide
CID 31628083
2-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pyridine-4-carboxamide
CID 106753513
2-(4-fluorophenoxy)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide
CID 38808772
(Z)-N'-(3-aminophenyl)-N-[3-(1H-pyrazol-5-yl)phenyl]oct-4-enediamide
CID 143464434
2-(2-methyl-4-phenylquinolin-3-yl)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide
CID 112820574

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide?
The IUPAC name of 2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide (CID 47842566) is 2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide is CC(C)(C)NCC(=O)Nc1cccc(-c2ccn[nH]2)c1.
What is the InChIKey of 2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide?
The InChIKey is BEVDYAOOJUJBSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-15(2,3)16-10-14(20)18-12-6-4-5-11(9-12)13-7-8-17-19-13/h4-9,16H,10H2,1-3H3,(H,17,19)(H,18,20).
What are the key properties of 2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide?
2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide has a molecular weight of 272.35 g/mol, XLogP of 2.40, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-N-[3-(1H-pyrazol-5-yl)phenyl]acetamide is sourced from PubChem (CID 47842566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).