2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide

C15H20N4O — CID 61113208

IUPAC2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide
SMILESCC(CCc1ccccc1)NC(=O)Cn1cc(N)cn1
InChIInChI=1S/C15H20N4O/c1-12(7-8-13-5-3-2-4-6-13)18-15(20)11-19-10-14(16)9-17-19/h2-6,9-10,12H,7-8,11,16H2,1H3,(H,18,20)
InChIKeyKVBLBDVIOMMGNB-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.60
Rot. Bonds6

About 2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide

2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide (PubChem CID 61113208) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide
PubChem CID61113208
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide
SMILESCC(CCc1ccccc1)NC(=O)Cn1cc(N)cn1
InChIInChI=1S/C15H20N4O/c1-12(7-8-13-5-3-2-4-6-13)18-15(20)11-19-10-14(16)9-17-19/h2-6,9-10,12H,7-8,11,16H2,1H3,(H,18,20)
InChIKeyKVBLBDVIOMMGNB-UHFFFAOYSA-N
XLogP1.60
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-aminopyrazol-1-yl)-N-[(2R)-1-hydroxypropan-2-yl]acetamide
CID 93081118
2-(4-aminopyrazol-1-yl)-N-heptan-2-ylacetamide
CID 43575022
2-(4-aminopyrazol-1-yl)-N-benzylacetamide
CID 28973852
2-(4-aminopyrazol-1-yl)-N-[5-(diethylamino)pentan-2-yl]acetamide
CID 43445359
N,N'-bis[(2S)-4-phenylbutan-2-yl]butanediamide
CID 7409928
3-oxo-3-(4-phenylbutan-2-ylamino)propanoic acid
CID 55049062
2-(4-aminopyrazol-1-yl)-N-(2-methylpropyl)acetamide
CID 43185729
N,N'-bis[(2R)-4-phenylbutan-2-yl]hexanediamide
CID 7406180
N-(4-phenylbutan-2-yl)-2-sulfanylacetamide
CID 60650069
N-[(2S)-4-(4-propan-2-yloxyphenyl)butan-2-yl]-2-pyrazol-1-ylacetamide
CID 94797701
3-amino-3-phenyl-N-(4-phenylbutan-2-yl)propanamide;hydrochloride
CID 119948730
2-(4-aminopyrazol-1-yl)-N-octan-4-ylacetamide
CID 106021739

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide?
The IUPAC name of 2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide (CID 61113208) is 2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide.
What is the SMILES notation for 2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide?
The canonical SMILES for 2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide is CC(CCc1ccccc1)NC(=O)Cn1cc(N)cn1.
What is the InChIKey of 2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide?
The InChIKey is KVBLBDVIOMMGNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-12(7-8-13-5-3-2-4-6-13)18-15(20)11-19-10-14(16)9-17-19/h2-6,9-10,12H,7-8,11,16H2,1H3,(H,18,20).
What are the key properties of 2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide?
2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide has a molecular weight of 272.35 g/mol, XLogP of 1.60, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopyrazol-1-yl)-N-(4-phenylbutan-2-yl)acetamide is sourced from PubChem (CID 61113208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).