N-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide

C20H23NO3 — CID 56552661

IUPACN-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide
SMILESCCc1ccc(O)c(C(=O)Nc2cccc(COCC3CC3)c2)c1
InChIInChI=1S/C20H23NO3/c1-2-14-8-9-19(22)18(11-14)20(23)21-17-5-3-4-16(10-17)13-24-12-15-6-7-15/h3-5,8-11,15,22H,2,6-7,12-13H2,1H3,(H,21,23)
InChIKeyJZLUYWAGAOLMNQ-UHFFFAOYSA-N
MW325.41 g/mol
LogP4.13
Rot. Bonds7

About N-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide

N-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide (PubChem CID 56552661) has the molecular formula C20H23NO3 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide.

Molecular Properties

Compound NameN-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide
PubChem CID56552661
Molecular FormulaC20H23NO3
Molecular Weight325.41 g/mol
Exact Mass325.17
IUPAC NameN-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide
SMILESCCc1ccc(O)c(C(=O)Nc2cccc(COCC3CC3)c2)c1
InChIInChI=1S/C20H23NO3/c1-2-14-8-9-19(22)18(11-14)20(23)21-17-5-3-4-16(10-17)13-24-12-15-6-7-15/h3-5,8-11,15,22H,2,6-7,12-13H2,1H3,(H,21,23)
InChIKeyJZLUYWAGAOLMNQ-UHFFFAOYSA-N
XLogP4.13
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(cyclopropylmethoxymethyl)phenyl]-3,4,5-trimethoxybenzamide
CID 48584262
4-(cyclopropanecarbonylamino)-N-[3-(cyclopropylmethoxymethyl)phenyl]benzamide
CID 48584588
1-[3-(cyclopropylmethoxymethyl)phenyl]-3-hexylurea
CID 60589978
4-amino-N-[3-(cyclopropylmethoxymethyl)phenyl]pentanamide
CID 120561459
1-[3-(cyclopropylmethoxymethyl)phenyl]-3-(1-hydroxypropan-2-yl)urea
CID 110907808
N-[3-(cyclopropylmethoxymethyl)phenyl]-4-methoxypiperidine-4-carboxamide
CID 119754019
2-methoxyethyl 5-[[3-(cyclopropylmethoxymethyl)phenyl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
CID 48585206
N-[3-(cyclopropylmethoxymethyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119754032
5-[(2-cyanophenoxy)methyl]-N-[3-(cyclopropylmethoxymethyl)phenyl]furan-2-carboxamide
CID 48585316
5-ethyl-2-hydroxy-N'-(2-hydroxybenzoyl)benzohydrazide
CID 60611924
1-[3-(cyclopropylmethoxymethyl)phenyl]-3-[(6-methyl-2-pyridinyl)methyl]urea
CID 48644122
1-N,3-N,5-N-tris(3-ethylphenyl)benzene-1,3,5-tricarboxamide
CID 67992311

Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide?
The IUPAC name of N-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide (CID 56552661) is N-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide.
What is the SMILES notation for N-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide?
The canonical SMILES for N-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide is CCc1ccc(O)c(C(=O)Nc2cccc(COCC3CC3)c2)c1.
What is the InChIKey of N-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide?
The InChIKey is JZLUYWAGAOLMNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO3/c1-2-14-8-9-19(22)18(11-14)20(23)21-17-5-3-4-16(10-17)13-24-12-15-6-7-15/h3-5,8-11,15,22H,2,6-7,12-13H2,1H3,(H,21,23).
What are the key properties of N-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide?
N-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide has a molecular weight of 325.41 g/mol, XLogP of 4.13, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclopropylmethoxymethyl)phenyl]-5-ethyl-2-hydroxybenzamide is sourced from PubChem (CID 56552661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).