1-decyl-4H-1,8-naphthyridine-3-carboxamide

C19H29N3O — CID 175151436

IUPAC1-decyl-4H-1,8-naphthyridine-3-carboxamide
SMILESCCCCCCCCCCN1C=C(C(N)=O)Cc2cccnc21
InChIInChI=1S/C19H29N3O/c1-2-3-4-5-6-7-8-9-13-22-15-17(18(20)23)14-16-11-10-12-21-19(16)22/h10-12,15H,2-9,13-14H2,1H3,(H2,20,23)
InChIKeyRXBPAWTWFMMYPZ-UHFFFAOYSA-N
MW315.46 g/mol
LogP3.95
Rot. Bonds10

About 1-decyl-4H-1,8-naphthyridine-3-carboxamide

1-decyl-4H-1,8-naphthyridine-3-carboxamide (PubChem CID 175151436) has the molecular formula C19H29N3O and a molecular weight of 315.46 g/mol. Its IUPAC name is 1-decyl-4H-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name1-decyl-4H-1,8-naphthyridine-3-carboxamide
PubChem CID175151436
Molecular FormulaC19H29N3O
Molecular Weight315.46 g/mol
Exact Mass315.23
IUPAC Name1-decyl-4H-1,8-naphthyridine-3-carboxamide
SMILESCCCCCCCCCCN1C=C(C(N)=O)Cc2cccnc21
InChIInChI=1S/C19H29N3O/c1-2-3-4-5-6-7-8-9-13-22-15-17(18(20)23)14-16-11-10-12-21-19(16)22/h10-12,15H,2-9,13-14H2,1H3,(H2,20,23)
InChIKeyRXBPAWTWFMMYPZ-UHFFFAOYSA-N
XLogP3.95
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.46
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-methyl-4H-1,8-naphthyridine-3-carboxamide
CID 151351767
1,4-dihydro-1,8-naphthyridine-3-carboxamide
CID 140520680
1-dodecyl-3-methyl-4H-quinoline
CID 89157959
2-(butylamino)pyridine-3-carboxamide
CID 29031037
1-(2-methyl-3-pyridinyl)hexan-1-one
CID 105087719
1-(3-hydroxy-2-pyridinyl)nonan-1-one
CID 137395419
2-(2-ethylhexyl)pyridine-3-carboxamide
CID 71001872
1-(2-methoxy-3-pyridinyl)octan-1-one
CID 105086571
bis(nonanoic acid);pyrimidin-2-amine
CID 139195998
1-(3-ethyl-2-pyridinyl)octan-1-one
CID 82730570
1-(thiadiazol-5-yl)-4H-1,8-naphthyridine-3-carboxylic acid
CID 175473829
2-[4-[3-(dimethylamino)-3-oxopropyl]piperazin-1-yl]pyridine-3-carboxamide
CID 132968653

Frequently Asked Questions

What is the IUPAC name of 1-decyl-4H-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 1-decyl-4H-1,8-naphthyridine-3-carboxamide (CID 175151436) is 1-decyl-4H-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 1-decyl-4H-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 1-decyl-4H-1,8-naphthyridine-3-carboxamide is CCCCCCCCCCN1C=C(C(N)=O)Cc2cccnc21.
What is the InChIKey of 1-decyl-4H-1,8-naphthyridine-3-carboxamide?
The InChIKey is RXBPAWTWFMMYPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O/c1-2-3-4-5-6-7-8-9-13-22-15-17(18(20)23)14-16-11-10-12-21-19(16)22/h10-12,15H,2-9,13-14H2,1H3,(H2,20,23).
What are the key properties of 1-decyl-4H-1,8-naphthyridine-3-carboxamide?
1-decyl-4H-1,8-naphthyridine-3-carboxamide has a molecular weight of 315.46 g/mol, XLogP of 3.95, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-decyl-4H-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 175151436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).