N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide

C15H18ClNO2 — CID 55232835

IUPACN-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide
SMILESO=C(NCC1CC2CCC1C2)c1cc(Cl)ccc1O
InChIInChI=1S/C15H18ClNO2/c16-12-3-4-14(18)13(7-12)15(19)17-8-11-6-9-1-2-10(11)5-9/h3-4,7,9-11,18H,1-2,5-6,8H2,(H,17,19)
InChIKeyULDDKSJYMVJDKN-UHFFFAOYSA-N
MW279.77 g/mol
LogP3.21
Rot. Bonds3

About N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide

N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide (PubChem CID 55232835) has the molecular formula C15H18ClNO2 and a molecular weight of 279.77 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide
PubChem CID55232835
Molecular FormulaC15H18ClNO2
Molecular Weight279.77 g/mol
Exact Mass279.10
IUPAC NameN-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide
SMILESO=C(NCC1CC2CCC1C2)c1cc(Cl)ccc1O
InChIInChI=1S/C15H18ClNO2/c16-12-3-4-14(18)13(7-12)15(19)17-8-11-6-9-1-2-10(11)5-9/h3-4,7,9-11,18H,1-2,5-6,8H2,(H,17,19)
InChIKeyULDDKSJYMVJDKN-UHFFFAOYSA-N
XLogP3.21
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.77
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-fluorobenzamide
CID 62613246
2-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chlorobenzamide
CID 63687169
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-bromo-5-chlorobenzamide
CID 113229608
N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-iodobenzamide
CID 113229546
N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydrazinylbenzamide
CID 63686504
5-amino-N-(2-bicyclo[2.2.1]heptanylmethyl)-2-chlorobenzamide
CID 63687178
N-(2-bicyclo[2.2.1]heptanylmethyl)-2-fluoro-5-sulfanylbenzamide
CID 107029927
5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide
CID 66005764
N-(2-bicyclo[2.2.1]heptanylmethyl)-4-hydroxy-3-methylbenzamide
CID 103956855
N-(2-bicyclo[2.2.1]heptanylmethyl)-3,6-dichloropyridazine-4-carboxamide
CID 114038502
N-[(Z)-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]methylideneamino]-5-chloro-2-hydroxybenzamide
CID 11880265
1-[[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]methyl]-3-(2,4-dichlorophenyl)urea
CID 40648978

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide (CID 55232835) is N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide is O=C(NCC1CC2CCC1C2)c1cc(Cl)ccc1O.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide?
The InChIKey is ULDDKSJYMVJDKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18ClNO2/c16-12-3-4-14(18)13(7-12)15(19)17-8-11-6-9-1-2-10(11)5-9/h3-4,7,9-11,18H,1-2,5-6,8H2,(H,17,19).
What are the key properties of N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide?
N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide has a molecular weight of 279.77 g/mol, XLogP of 3.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide is sourced from PubChem (CID 55232835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).