N-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide

C16H23ClN2O2 — CID 65123307

IUPACN-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide
SMILESO=C(CNCC1(O)CCCCCC1)Nc1ccccc1Cl
InChIInChI=1S/C16H23ClN2O2/c17-13-7-3-4-8-14(13)19-15(20)11-18-12-16(21)9-5-1-2-6-10-16/h3-4,7-8,18,21H,1-2,5-6,9-12H2,(H,19,20)
InChIKeyYHYNETQJRNWJFH-UHFFFAOYSA-N
MW310.82 g/mol
LogP2.95
Rot. Bonds5

About N-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide

N-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide (PubChem CID 65123307) has the molecular formula C16H23ClN2O2 and a molecular weight of 310.82 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide
PubChem CID65123307
Molecular FormulaC16H23ClN2O2
Molecular Weight310.82 g/mol
Exact Mass310.14
IUPAC NameN-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide
SMILESO=C(CNCC1(O)CCCCCC1)Nc1ccccc1Cl
InChIInChI=1S/C16H23ClN2O2/c17-13-7-3-4-8-14(13)19-15(20)11-18-12-16(21)9-5-1-2-6-10-16/h3-4,7-8,18,21H,1-2,5-6,9-12H2,(H,19,20)
InChIKeyYHYNETQJRNWJFH-UHFFFAOYSA-N
XLogP2.95
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.82
LogP ≤ 52.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1-hydroxycycloheptyl)methylamino]-N-phenylacetamide
CID 65122153
N-(2-chlorophenyl)-2-[[1-(hydroxymethyl)cyclopropyl]methylamino]acetamide
CID 113313241
N'-(2-chlorophenyl)-N-[(1-hydroxycycloheptyl)methyl]oxamide
CID 111435658
2-[(1-hydroxycyclopentyl)methylamino]-N-(2-methoxyphenyl)acetamide
CID 65109213
N-(2-chlorophenyl)-2-(2-pyrrolidin-1-ylethylamino)acetamide
CID 60660334
N-(4-bromophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide
CID 65122968
N-benzyl-2-[(1-hydroxycycloheptyl)methylamino]acetamide
CID 60971311
2-[(4-hydroxyoxan-4-yl)methylamino]-N-(2-methylphenyl)acetamide
CID 81130530
2-[1-(aminomethyl)cyclohexyl]-N-(2-chlorophenyl)acetamide
CID 104677439
2-(azepan-1-yl)-N-(2-chlorophenyl)acetamide
CID 2070988
N-(2-chlorophenyl)-2-(prop-2-enylamino)acetamide
CID 28563439
N-(2-bromophenyl)-2-[(1-hydroxy-4-methylcyclohexyl)methylamino]acetamide
CID 65116145

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide (CID 65123307) is N-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide is O=C(CNCC1(O)CCCCCC1)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide?
The InChIKey is YHYNETQJRNWJFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23ClN2O2/c17-13-7-3-4-8-14(13)19-15(20)11-18-12-16(21)9-5-1-2-6-10-16/h3-4,7-8,18,21H,1-2,5-6,9-12H2,(H,19,20).
What are the key properties of N-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide?
N-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide has a molecular weight of 310.82 g/mol, XLogP of 2.95, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-[(1-hydroxycycloheptyl)methylamino]acetamide is sourced from PubChem (CID 65123307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).