2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide

C15H24N2O2 — CID 82978784

IUPAC2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide
SMILESCC(C)N(CC(N)=O)C(C)CCc1ccc(O)cc1
InChIInChI=1S/C15H24N2O2/c1-11(2)17(10-15(16)19)12(3)4-5-13-6-8-14(18)9-7-13/h6-9,11-12,18H,4-5,10H2,1-3H3,(H2,16,19)
InChIKeyJLHIGHKESLZIBG-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.91
Rot. Bonds7

About 2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide

2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide (PubChem CID 82978784) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide.

Molecular Properties

Compound Name2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide
PubChem CID82978784
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide
SMILESCC(C)N(CC(N)=O)C(C)CCc1ccc(O)cc1
InChIInChI=1S/C15H24N2O2/c1-11(2)17(10-15(16)19)12(3)4-5-13-6-8-14(18)9-7-13/h6-9,11-12,18H,4-5,10H2,1-3H3,(H2,16,19)
InChIKeyJLHIGHKESLZIBG-UHFFFAOYSA-N
XLogP1.91
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(4-hydroxyphenyl)ethyl-propan-2-ylamino]acetamide
CID 82978295
4-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]butanoic acid
CID 65058434
2-[1-(4-hydroxyphenyl)propan-2-yl-methylamino]acetamide
CID 80505706
2-[2-(dimethylamino)ethyl-[4-(4-hydroxyphenyl)butan-2-yl]amino]acetic acid
CID 107426370
3-[4-(4-hydroxyphenyl)butan-2-yl-methylamino]-2-methylpropanoic acid
CID 65067286
2-[ethyl-[(4-hydroxyphenyl)methyl]amino]acetamide
CID 88657725
4-(3-methylpentyl)phenol
CID 57225129
4-(4-hydroxyphenyl)-2-iodobutanamide
CID 57297993
4-[4-(4-hydroxyphenyl)butan-2-yl-methylamino]butanoic acid
CID 65067870
4-(3,5-dimethyloctyl)phenol
CID 174906830
2-[4-(4-hydroxyphenyl)butan-2-ylamino]-2-methylpropanamide
CID 61212956
4-[3-[(3-amino-4-methylpentyl)-methylamino]butyl]phenol
CID 115317129

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide?
The IUPAC name of 2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide (CID 82978784) is 2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide.
What is the SMILES notation for 2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide?
The canonical SMILES for 2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide is CC(C)N(CC(N)=O)C(C)CCc1ccc(O)cc1.
What is the InChIKey of 2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide?
The InChIKey is JLHIGHKESLZIBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)17(10-15(16)19)12(3)4-5-13-6-8-14(18)9-7-13/h6-9,11-12,18H,4-5,10H2,1-3H3,(H2,16,19).
What are the key properties of 2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide?
2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide has a molecular weight of 264.37 g/mol, XLogP of 1.91, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-hydroxyphenyl)butan-2-yl-propan-2-ylamino]acetamide is sourced from PubChem (CID 82978784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).