1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide

C16H19NO3 — CID 60747623

IUPAC1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide
SMILESCCCN(CCO)C(=O)c1ccc2ccccc2c1O
InChIInChI=1S/C16H19NO3/c1-2-9-17(10-11-18)16(20)14-8-7-12-5-3-4-6-13(12)15(14)19/h3-8,18-19H,2,9-11H2,1H3
InChIKeyNSHSPTLIYBREEN-UHFFFAOYSA-N
MW273.33 g/mol
LogP2.39
Rot. Bonds5

About 1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide

1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide (PubChem CID 60747623) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is 1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide.

Molecular Properties

Compound Name1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide
PubChem CID60747623
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC Name1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide
SMILESCCCN(CCO)C(=O)c1ccc2ccccc2c1O
InChIInChI=1S/C16H19NO3/c1-2-9-17(10-11-18)16(20)14-8-7-12-5-3-4-6-13(12)15(14)19/h3-8,18-19H,2,9-11H2,1H3
InChIKeyNSHSPTLIYBREEN-UHFFFAOYSA-N
XLogP2.39
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-aminopropyl)-N-ethyl-1-hydroxynaphthalene-2-carboxamide
CID 43319188
2-hydroxy-N-(2-hydroxyethyl)-3-methoxy-N-propylbenzamide
CID 60655994
N-ethyl-1-hydroxy-N-prop-2-ynylnaphthalene-2-carboxamide
CID 78971167
1-(1-hydroxynaphthalen-2-yl)ethanone;vanadium
CID 174557605
N-(2-hydroxyethyl)-1-oxo-N-propyl-2H-isoquinoline-3-carboxamide
CID 60743064
1-(1-hydroxynaphthalen-2-yl)ethanone;vanadium;trichloride
CID 174494917
3-[(1-hydroxynaphthalene-2-carbonyl)-methylamino]propanoic acid
CID 60988949
2-[4-(diethylamino)-2-hydroxybenzoyl]-N-(2-hydroxyethyl)-N-propylbenzamide
CID 59713083
2,5-dihydroxy-N-(2-hydroxyethyl)-N-propylbenzamide
CID 107722509
3-hydroxy-N-(2-hydroxyethyl)-N-propylbenzamide
CID 60655677
N-(2-hydroxyethyl)-1-(methylamino)-N-propylisoquinoline-3-carboxamide
CID 62174192
2,4-dichloro-N-(2-hydroxyethyl)-N-propylbenzamide
CID 60655751

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide?
The IUPAC name of 1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide (CID 60747623) is 1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide.
What is the SMILES notation for 1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide?
The canonical SMILES for 1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide is CCCN(CCO)C(=O)c1ccc2ccccc2c1O.
What is the InChIKey of 1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide?
The InChIKey is NSHSPTLIYBREEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c1-2-9-17(10-11-18)16(20)14-8-7-12-5-3-4-6-13(12)15(14)19/h3-8,18-19H,2,9-11H2,1H3.
What are the key properties of 1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide?
1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide has a molecular weight of 273.33 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-(2-hydroxyethyl)-N-propylnaphthalene-2-carboxamide is sourced from PubChem (CID 60747623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).