2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide

C15H24N2O3 — CID 104892113

IUPAC2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CNC(CCO)C(C)C
InChIInChI=1S/C15H24N2O3/c1-11(2)12(8-9-18)16-10-15(19)17-13-6-4-5-7-14(13)20-3/h4-7,11-12,16,18H,8-10H2,1-3H3,(H,17,19)
InChIKeyQNSJLLJTEPQKBI-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.63
Rot. Bonds8

About 2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide

2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide (PubChem CID 104892113) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide
PubChem CID104892113
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CNC(CCO)C(C)C
InChIInChI=1S/C15H24N2O3/c1-11(2)12(8-9-18)16-10-15(19)17-13-6-4-5-7-14(13)20-3/h4-7,11-12,16,18H,8-10H2,1-3H3,(H,17,19)
InChIKeyQNSJLLJTEPQKBI-UHFFFAOYSA-N
XLogP1.63
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(butan-2-ylamino)-N-(2-methoxyphenyl)acetamide
CID 43179381
2-[[(1S)-1-(2,4-difluorophenyl)ethyl]amino]-N-(2-methoxyphenyl)acetamide
CID 9369939
N-(2-methoxyphenyl)-2-(2-methylpropylamino)acetamide
CID 9322485
1-(4-hydroxybutan-2-yl)-3-(2-methoxyphenyl)urea
CID 78998444
2-(2-methoxyanilino)-N-[2-(2-methylpropoxy)phenyl]acetamide
CID 54817214
2-[1-(3-fluorophenyl)ethylamino]-N-(2-methoxyphenyl)acetamide
CID 42914238
2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(4-methylphenyl)acetamide
CID 104696173
N-(2-methoxyphenyl)-2-[[(1S)-1-naphthalen-1-ylethyl]amino]acetamide
CID 9397269
N-(2-methoxyphenyl)-2-[[(R)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 9392871
2-[[(1R)-1-(2,4-dichloro-5-fluorophenyl)ethyl]amino]-N-(2-methoxyphenyl)acetamide
CID 9377633
2-cyclopropyl-2-[[2-(2-methoxyanilino)-2-oxoethyl]amino]acetic acid
CID 62696962
N-(2-methoxyphenyl)-N'-(2-propan-2-yloxyphenyl)propanediamide
CID 108955532

Frequently Asked Questions

What is the IUPAC name of 2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide (CID 104892113) is 2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)CNC(CCO)C(C)C.
What is the InChIKey of 2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide?
The InChIKey is QNSJLLJTEPQKBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-11(2)12(8-9-18)16-10-15(19)17-13-6-4-5-7-14(13)20-3/h4-7,11-12,16,18H,8-10H2,1-3H3,(H,17,19).
What are the key properties of 2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide?
2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide has a molecular weight of 280.37 g/mol, XLogP of 1.63, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-hydroxy-4-methylpentan-3-yl)amino]-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 104892113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).