N-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide

C15H18N2O2 — CID 3659429

IUPACN-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide
SMILESCN(C)CCNC(=O)c1cc2ccccc2cc1O
InChIInChI=1S/C15H18N2O2/c1-17(2)8-7-16-15(19)13-9-11-5-3-4-6-12(11)10-14(13)18/h3-6,9-10,18H,7-8H2,1-2H3,(H,16,19)
InChIKeyPTYBNDTVHWXPPT-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.84
Rot. Bonds4

About N-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide

N-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide (PubChem CID 3659429) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide
PubChem CID3659429
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide
SMILESCN(C)CCNC(=O)c1cc2ccccc2cc1O
InChIInChI=1S/C15H18N2O2/c1-17(2)8-7-16-15(19)13-9-11-5-3-4-6-12(11)10-14(13)18/h3-6,9-10,18H,7-8H2,1-2H3,(H,16,19)
InChIKeyPTYBNDTVHWXPPT-UHFFFAOYSA-N
XLogP1.84
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,N'-1,2-Ethanediylbis(2-hydroxybenzamide)
CID 95934
2-Naphthalenecarboxamide, 3-hydroxy-N-[3-(4-morpholinyl)propyl]-
CID 82414
3-Hydroxy-N-(2-hydroxyethyl)-2-naphthoamide
CID 66722
2-Naphthalenecarboxamide, N-[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butyl]-1-hydroxy-
CID 122566
1-Hydroxy-2-naphthoyl-Arg-Pro amide
CID 177340
Benzamide, N-[(2-hydroxy-1-naphthalenyl)methyl]-
CID 796808
3-(Pyrrolidin-1-ylcarbonyl)-2-naphthol
CID 5303039
Biphenyl-4-carboxylic acid {4-[(5-hydroxy-1,2,3,4-tetrahydro-naphthalen-2-yl)-propyl-amino]-butyl}-amide
CID 19592091
3-[(4-Methylpiperazin-1-yl)carbonyl]-2-naphthol
CID 698250
2-Naphthalenecarboxamide, N-[2-[2-(acetylamino)phenyl]ethyl]-1-hydroxy-
CID 21325
N-Butyl-2-hydroxy(1,1'-biphenyl)-3-carboxamide
CID 8579
3-Hydroxy-2-naphthalenecarboxamide
CID 19317

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide (CID 3659429) is N-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide is CN(C)CCNC(=O)c1cc2ccccc2cc1O.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide?
The InChIKey is PTYBNDTVHWXPPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-17(2)8-7-16-15(19)13-9-11-5-3-4-6-12(11)10-14(13)18/h3-6,9-10,18H,7-8H2,1-2H3,(H,16,19).
What are the key properties of N-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide?
N-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 1.84, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-3-hydroxynaphthalene-2-carboxamide is sourced from PubChem (CID 3659429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).