2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide

C17H23N3O2 — CID 155958535

IUPAC2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)Cn1ccnc1CCCO
InChIInChI=1S/C17H23N3O2/c1-13(2)14-6-3-4-7-15(14)19-17(22)12-20-10-9-18-16(20)8-5-11-21/h3-4,6-7,9-10,13,21H,5,8,11-12H2,1-2H3,(H,19,22)
InChIKeyPFOZAUSPOQQJMP-UHFFFAOYSA-N
MW301.39 g/mol
LogP2.57
Rot. Bonds7

About 2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide

2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide (PubChem CID 155958535) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is 2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide
PubChem CID155958535
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC Name2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)Cn1ccnc1CCCO
InChIInChI=1S/C17H23N3O2/c1-13(2)14-6-3-4-7-15(14)19-17(22)12-20-10-9-18-16(20)8-5-11-21/h3-4,6-7,9-10,13,21H,5,8,11-12H2,1-2H3,(H,19,22)
InChIKeyPFOZAUSPOQQJMP-UHFFFAOYSA-N
XLogP2.57
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-bromophenyl)-2-[2-(hydroxymethyl)imidazol-1-yl]acetamide
CID 62221758
2-(2-ethylimidazol-1-yl)-N-(2-methylphenyl)acetamide
CID 63811305
2-[2-(hydroxymethyl)imidazol-1-yl]-N-phenylacetamide
CID 62221393
2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-(2-propan-2-ylphenyl)acetamide
CID 110877789
2-[2-(3-hydroxypropyl)pyrrolidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide
CID 110918990
N-(2-propan-2-ylphenyl)propanamide
CID 723442
2-iodo-N-(2-propan-2-ylphenyl)acetamide
CID 4198881
2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-N-(2-propan-2-ylphenyl)acetamide
CID 1078247
2-[3-(2-hydroxyethyl)pyrrolidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide
CID 115647804
5-chloro-N-(2-propan-2-ylphenyl)pentanamide
CID 28727835
(2S)-2-[[2-oxo-2-(2-propan-2-ylanilino)ethyl]amino]propanoic acid
CID 83194689
2-butylsulfanyl-N-(2-propan-2-ylphenyl)acetamide
CID 112781301

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide (CID 155958535) is 2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide is CC(C)c1ccccc1NC(=O)Cn1ccnc1CCCO.
What is the InChIKey of 2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide?
The InChIKey is PFOZAUSPOQQJMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-13(2)14-6-3-4-7-15(14)19-17(22)12-20-10-9-18-16(20)8-5-11-21/h3-4,6-7,9-10,13,21H,5,8,11-12H2,1-2H3,(H,19,22).
What are the key properties of 2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide?
2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide has a molecular weight of 301.39 g/mol, XLogP of 2.57, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-hydroxypropyl)imidazol-1-yl]-N-(2-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 155958535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).