N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide

C16H23NO2 — CID 43409240

IUPACN-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide
SMILESCc1ccc(O)c(C(=O)N(C)C2CCCCCC2)c1
InChIInChI=1S/C16H23NO2/c1-12-9-10-15(18)14(11-12)16(19)17(2)13-7-5-3-4-6-8-13/h9-11,13,18H,3-8H2,1-2H3
InChIKeyRKDTVMHQIIPEJE-UHFFFAOYSA-N
MW261.37 g/mol
LogP3.50
Rot. Bonds2

About N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide

N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide (PubChem CID 43409240) has the molecular formula C16H23NO2 and a molecular weight of 261.37 g/mol. Its IUPAC name is N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide.

Molecular Properties

Compound NameN-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide
PubChem CID43409240
Molecular FormulaC16H23NO2
Molecular Weight261.37 g/mol
Exact Mass261.17
IUPAC NameN-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide
SMILESCc1ccc(O)c(C(=O)N(C)C2CCCCCC2)c1
InChIInChI=1S/C16H23NO2/c1-12-9-10-15(18)14(11-12)16(19)17(2)13-7-5-3-4-6-8-13/h9-11,13,18H,3-8H2,1-2H3
InChIKeyRKDTVMHQIIPEJE-UHFFFAOYSA-N
XLogP3.50
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-2-fluoro-N,5-dimethylbenzamide
CID 62510377
2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide
CID 102632488
2-amino-N-cyclopentyl-N,5-dimethylbenzamide
CID 62509333
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-hydroxy-N,5-dimethylbenzamide
CID 61233345
N-cyclopentyl-2-hydrazinyl-N,5-dimethylbenzamide
CID 62513481
N-cyclopropyl-2,5-dihydroxy-N-methylbenzamide
CID 107722324
N-cyclopentyl-2-(3-hydroxyprop-1-ynyl)-N,5-dimethylbenzamide
CID 81111346
N-cycloheptyl-4-fluoro-N,2-dimethylbenzamide
CID 113268593
5-amino-N-cyclooctyl-N,2-dimethylbenzamide
CID 120629477
3-chloro-N-cycloheptyl-4-hydroxy-N-methylbenzamide
CID 43409239
N-(4-aminocyclohexyl)-N,2,5-trimethylbenzamide
CID 79121701
N-(azepan-4-yl)-5-chloro-2-hydroxy-N-methylbenzamide
CID 107172538

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide?
The IUPAC name of N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide (CID 43409240) is N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide.
What is the SMILES notation for N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide?
The canonical SMILES for N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide is Cc1ccc(O)c(C(=O)N(C)C2CCCCCC2)c1.
What is the InChIKey of N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide?
The InChIKey is RKDTVMHQIIPEJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-12-9-10-15(18)14(11-12)16(19)17(2)13-7-5-3-4-6-8-13/h9-11,13,18H,3-8H2,1-2H3.
What are the key properties of N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide?
N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide has a molecular weight of 261.37 g/mol, XLogP of 3.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide is sourced from PubChem (CID 43409240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).