2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide

C17H28N2O2 — CID 111543424

IUPAC2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(CO)N(CC(=O)NC(C)(C)CC)c1ccccc1
InChIInChI=1S/C17H28N2O2/c1-5-14(13-20)19(15-10-8-7-9-11-15)12-16(21)18-17(3,4)6-2/h7-11,14,20H,5-6,12-13H2,1-4H3,(H,18,21)
InChIKeyWPFJILVTPWXNMQ-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.57
Rot. Bonds8

About 2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide

2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide (PubChem CID 111543424) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide
PubChem CID111543424
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(CO)N(CC(=O)NC(C)(C)CC)c1ccccc1
InChIInChI=1S/C17H28N2O2/c1-5-14(13-20)19(15-10-8-7-9-11-15)12-16(21)18-17(3,4)6-2/h7-11,14,20H,5-6,12-13H2,1-4H3,(H,18,21)
InChIKeyWPFJILVTPWXNMQ-UHFFFAOYSA-N
XLogP2.57
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(N-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]anilino)acetic acid
CID 60839780
2-[N-(1-hydroxybutan-2-yl)anilino]-N-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 111543415
N-(2-methylbutan-2-yl)-3,3-diphenylpropanamide
CID 1292106
2-(N-(2-fluorophenyl)sulfonylanilino)-N-(2-methylbutan-2-yl)acetamide
CID 36574960
2-[N-(1-hydroxybutan-2-yl)anilino]acetonitrile
CID 111543401
N-[2-[N-(1-hydroxybutan-2-yl)anilino]ethyl]methanesulfonamide
CID 111543476
2-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]acetic acid
CID 43442688
benzhydryl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]azanium
CID 8596761
2-methyl-3-[methyl-[2-(2-methylbutan-2-ylamino)-2-oxoethyl]amino]propanoic acid
CID 55007733
N-[4-[[N-(1-hydroxybutan-2-yl)anilino]methyl]-1,3-thiazol-2-yl]acetamide
CID 111825584
1-N-tert-butyl-2-N-ethyl-2-N-phenylbutane-1,2-diamine
CID 62424673
2-(2-bromoanilino)-N-(2-methylbutan-2-yl)acetamide
CID 51252444

Frequently Asked Questions

What is the IUPAC name of 2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide (CID 111543424) is 2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide is CCC(CO)N(CC(=O)NC(C)(C)CC)c1ccccc1.
What is the InChIKey of 2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide?
The InChIKey is WPFJILVTPWXNMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-5-14(13-20)19(15-10-8-7-9-11-15)12-16(21)18-17(3,4)6-2/h7-11,14,20H,5-6,12-13H2,1-4H3,(H,18,21).
What are the key properties of 2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide?
2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide has a molecular weight of 292.42 g/mol, XLogP of 2.57, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[N-(1-hydroxybutan-2-yl)anilino]-N-(2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 111543424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).