N-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide

C19H24N4O3 — CID 166286449

IUPACN-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide
SMILESCN(C)CCOc1cccc(NC(=O)c2cc(=O)[nH]c3c2CNCC3)c1
InChIInChI=1S/C19H24N4O3/c1-23(2)8-9-26-14-5-3-4-13(10-14)21-19(25)15-11-18(24)22-17-6-7-20-12-16(15)17/h3-5,10-11,20H,6-9,12H2,1-2H3,(H,21,25)(H,22,24)
InChIKeyHTTHNVPFUOGNCM-UHFFFAOYSA-N
MW356.43 g/mol
LogP1.21
Rot. Bonds6

About N-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide

N-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide (PubChem CID 166286449) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is N-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide.

Molecular Properties

Compound NameN-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide
PubChem CID166286449
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC NameN-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide
SMILESCN(C)CCOc1cccc(NC(=O)c2cc(=O)[nH]c3c2CNCC3)c1
InChIInChI=1S/C19H24N4O3/c1-23(2)8-9-26-14-5-3-4-13(10-14)21-19(25)15-11-18(24)22-17-6-7-20-12-16(15)17/h3-5,10-11,20H,6-9,12H2,1-2H3,(H,21,25)(H,22,24)
InChIKeyHTTHNVPFUOGNCM-UHFFFAOYSA-N
XLogP1.21
TPSA86.46 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 51.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

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N-[3-[2-(dimethylamino)ethoxy]phenyl]-4-methoxypiperidine-4-carboxamide
CID 119844483
N-[3-[2-(dimethylamino)ethoxy]phenyl]-1-benzothiophene-3-carboxamide
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CID 60776296
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CID 60776294
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CID 63715447
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1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide
CID 65464434
3-amino-4-[3-[2-(dimethylamino)ethoxy]anilino]-4-oxobutanoic acid
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CID 119885879

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide?
The IUPAC name of N-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide (CID 166286449) is N-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide.
What is the SMILES notation for N-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide?
The canonical SMILES for N-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide is CN(C)CCOc1cccc(NC(=O)c2cc(=O)[nH]c3c2CNCC3)c1.
What is the InChIKey of N-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide?
The InChIKey is HTTHNVPFUOGNCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c1-23(2)8-9-26-14-5-3-4-13(10-14)21-19(25)15-11-18(24)22-17-6-7-20-12-16(15)17/h3-5,10-11,20H,6-9,12H2,1-2H3,(H,21,25)(H,22,24).
What are the key properties of N-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide?
N-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide has a molecular weight of 356.43 g/mol, XLogP of 1.21, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(dimethylamino)ethoxy]phenyl]-2-oxo-5,6,7,8-tetrahydro-1H-1,6-naphthyridine-4-carboxamide is sourced from PubChem (CID 166286449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).