3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide

C21H28N2O3 — CID 46540851

IUPAC3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide
SMILESCC(C)CC(CNC(=O)c1cc2ccccc2cc1O)N1CCOCC1
InChIInChI=1S/C21H28N2O3/c1-15(2)11-18(23-7-9-26-10-8-23)14-22-21(25)19-12-16-5-3-4-6-17(16)13-20(19)24/h3-6,12-13,15,18,24H,7-11,14H2,1-2H3,(H,22,25)
InChIKeyFBZRBPMDMLGELP-UHFFFAOYSA-N
MW356.47 g/mol
LogP3.02
Rot. Bonds6

About 3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide

3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide (PubChem CID 46540851) has the molecular formula C21H28N2O3 and a molecular weight of 356.47 g/mol. Its IUPAC name is 3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide
PubChem CID46540851
Molecular FormulaC21H28N2O3
Molecular Weight356.47 g/mol
Exact Mass356.21
IUPAC Name3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide
SMILESCC(C)CC(CNC(=O)c1cc2ccccc2cc1O)N1CCOCC1
InChIInChI=1S/C21H28N2O3/c1-15(2)11-18(23-7-9-26-10-8-23)14-22-21(25)19-12-16-5-3-4-6-17(16)13-20(19)24/h3-6,12-13,15,18,24H,7-11,14H2,1-2H3,(H,22,25)
InChIKeyFBZRBPMDMLGELP-UHFFFAOYSA-N
XLogP3.02
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-hydroxy-4-methoxy-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 43050142
5-chloro-2-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 43050180
N-(4-methyl-2-morpholin-4-ylpentyl)-2-naphthalen-2-ylacetamide
CID 46540850
2-methoxy-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 110403268
2-ethoxy-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 134027029
N-(4-methyl-2-morpholin-4-ylpentyl)-2-oxo-1H-quinoline-4-carboxamide
CID 134027047
N-(4-methyl-2-morpholin-4-ylpentyl)-1-oxo-2H-isoquinoline-3-carboxamide
CID 134027137
4-fluoro-2-iodo-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 55688167
2,5-dimethyl-N-(4-methyl-2-morpholin-4-ylpentyl)-1-pyridin-2-ylpyrrole-3-carboxamide
CID 55734741
N-(4-methyl-2-morpholin-4-ylpentyl)-3-phenylmethoxybenzamide
CID 46540846
4-(difluoromethoxy)-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 134027068
2-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide
CID 46541190

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide?
The IUPAC name of 3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide (CID 46540851) is 3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide.
What is the SMILES notation for 3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide?
The canonical SMILES for 3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide is CC(C)CC(CNC(=O)c1cc2ccccc2cc1O)N1CCOCC1.
What is the InChIKey of 3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide?
The InChIKey is FBZRBPMDMLGELP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O3/c1-15(2)11-18(23-7-9-26-10-8-23)14-22-21(25)19-12-16-5-3-4-6-17(16)13-20(19)24/h3-6,12-13,15,18,24H,7-11,14H2,1-2H3,(H,22,25).
What are the key properties of 3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide?
3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide has a molecular weight of 356.47 g/mol, XLogP of 3.02, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)naphthalene-2-carboxamide is sourced from PubChem (CID 46540851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).