N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide

C14H19NO2 — CID 82829503

IUPACN-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide
SMILESCCN(CC1CC1)C(=O)c1cccc(O)c1C
InChIInChI=1S/C14H19NO2/c1-3-15(9-11-7-8-11)14(17)12-5-4-6-13(16)10(12)2/h4-6,11,16H,3,7-9H2,1-2H3
InChIKeyFBGPLRAQSRDENR-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.57
Rot. Bonds4

About N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide

N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide (PubChem CID 82829503) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide
PubChem CID82829503
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide
SMILESCCN(CC1CC1)C(=O)c1cccc(O)c1C
InChIInChI=1S/C14H19NO2/c1-3-15(9-11-7-8-11)14(17)12-5-4-6-13(16)10(12)2/h4-6,11,16H,3,7-9H2,1-2H3
InChIKeyFBGPLRAQSRDENR-UHFFFAOYSA-N
XLogP2.57
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopropylmethyl)-3-hydroxy-2-methyl-N-propan-2-ylbenzamide
CID 82829027
N-(cyclobutylmethyl)-3-hydroxy-N,2-dimethylbenzamide
CID 82829035
N-(cyclopentylmethyl)-3-hydroxy-N,2-dimethylbenzamide
CID 82828965
N-ethyl-3-hydroxy-2-methyl-N-(2-methylpropyl)benzamide
CID 82830028
N-ethyl-3-hydroxy-N-(2-hydroxy-2-methylpropyl)-2-methylbenzamide
CID 82829511
N-(cyclopropylmethyl)-N-ethyl-3-hydroxypyridine-2-carboxamide
CID 63955616
N-(cyclopropylmethyl)-N-ethyl-2-fluoro-6-hydroxybenzamide
CID 104917550
N,N-bis(cyclopropylmethyl)-2,3-dihydroxybenzamide
CID 114344418
N-[3-(dimethylamino)propyl]-N-ethyl-3-hydroxy-2-methylbenzamide
CID 102978926
N-ethyl-N-[2-(ethylamino)-2-oxoethyl]-3-hydroxy-2-methylbenzamide
CID 82795366
N-ethyl-2,6-dihydroxy-N-(piperidin-4-ylmethyl)benzamide
CID 107690375
2-[cyclobutylmethyl(ethyl)carbamoyl]benzoic acid
CID 107397528

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide?
The IUPAC name of N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide (CID 82829503) is N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide is CCN(CC1CC1)C(=O)c1cccc(O)c1C.
What is the InChIKey of N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide?
The InChIKey is FBGPLRAQSRDENR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-3-15(9-11-7-8-11)14(17)12-5-4-6-13(16)10(12)2/h4-6,11,16H,3,7-9H2,1-2H3.
What are the key properties of N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide?
N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide has a molecular weight of 233.31 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-ethyl-3-hydroxy-2-methylbenzamide is sourced from PubChem (CID 82829503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).