2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide

C16H24N2O3 — CID 60997345

IUPAC2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide
SMILESCOc1cc(C(NC2CCCCCC2)C(N)=O)ccc1O
InChIInChI=1S/C16H24N2O3/c1-21-14-10-11(8-9-13(14)19)15(16(17)20)18-12-6-4-2-3-5-7-12/h8-10,12,15,18-19H,2-7H2,1H3,(H2,17,20)
InChIKeyMYTPQKJLWGAYMK-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.24
Rot. Bonds5

About 2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide

2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide (PubChem CID 60997345) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide
PubChem CID60997345
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide
SMILESCOc1cc(C(NC2CCCCCC2)C(N)=O)ccc1O
InChIInChI=1S/C16H24N2O3/c1-21-14-10-11(8-9-13(14)19)15(16(17)20)18-12-6-4-2-3-5-7-12/h8-10,12,15,18-19H,2-7H2,1H3,(H2,17,20)
InChIKeyMYTPQKJLWGAYMK-UHFFFAOYSA-N
XLogP2.24
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(cyclohexylamino)-2-(6-methoxy-3-pyridinyl)acetamide
CID 114937363
2-(cyclohexylamino)-2-(4-propan-2-yloxyphenyl)acetamide
CID 60997329
2-(cyclohexylamino)-2-(4-ethoxyphenyl)acetamide
CID 60998636
2-(butan-2-ylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide
CID 54908186
2-(5-bromo-2-methoxyphenyl)-2-(cyclopentylamino)acetamide
CID 54894280
2-(cycloheptylamino)-2-(3-fluoro-4-methoxyphenyl)acetic acid
CID 65096305
2-(cycloheptylamino)-2-(4-ethylphenyl)acetamide
CID 60997559
methyl 2-(cyclopentylamino)-2-(3,4-dimethylphenyl)acetate
CID 54894017
2-(cyclopropylamino)-2-(3,5-dimethoxyphenyl)acetamide
CID 60796181
2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetamide
CID 22339410
2-(cyclohexylamino)-2-(4-methoxyphenyl)acetic acid
CID 54892880
2-(cyclopentylamino)-2-(4-propoxyphenyl)acetamide
CID 62495956

Frequently Asked Questions

What is the IUPAC name of 2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide?
The IUPAC name of 2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide (CID 60997345) is 2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide?
The canonical SMILES for 2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide is COc1cc(C(NC2CCCCCC2)C(N)=O)ccc1O.
What is the InChIKey of 2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide?
The InChIKey is MYTPQKJLWGAYMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-21-14-10-11(8-9-13(14)19)15(16(17)20)18-12-6-4-2-3-5-7-12/h8-10,12,15,18-19H,2-7H2,1H3,(H2,17,20).
What are the key properties of 2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide?
2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide has a molecular weight of 292.38 g/mol, XLogP of 2.24, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cycloheptylamino)-2-(4-hydroxy-3-methoxyphenyl)acetamide is sourced from PubChem (CID 60997345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).