2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide

C11H9Cl2N3O — CID 91619436

IUPAC2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide
SMILESCCNC(=O)c1c(Cl)nc2ncccc2c1Cl
InChIInChI=1S/C11H9Cl2N3O/c1-2-14-11(17)7-8(12)6-4-3-5-15-10(6)16-9(7)13/h3-5H,2H2,1H3,(H,14,17)
InChIKeyBHODTHNRJXBONE-UHFFFAOYSA-N
MW270.12 g/mol
LogP2.69
Rot. Bonds2

About 2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide

2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide (PubChem CID 91619436) has the molecular formula C11H9Cl2N3O and a molecular weight of 270.12 g/mol. Its IUPAC name is 2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide
PubChem CID91619436
Molecular FormulaC11H9Cl2N3O
Molecular Weight270.12 g/mol
Exact Mass269.01
IUPAC Name2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide
SMILESCCNC(=O)c1c(Cl)nc2ncccc2c1Cl
InChIInChI=1S/C11H9Cl2N3O/c1-2-14-11(17)7-8(12)6-4-3-5-15-10(6)16-9(7)13/h3-5H,2H2,1H3,(H,14,17)
InChIKeyBHODTHNRJXBONE-UHFFFAOYSA-N
XLogP2.69
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.12
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2,4-dichloro-N,N-dimethyl-1,8-naphthyridine-3-carboxamide
CID 3079845
2-chloro-N-ethylpyridine-3-carboxamide
CID 9182570
3,4-dichloro-N-ethylpyridine-2-carboxamide
CID 123182063
N-ethyl-2-methylsulfanylpyridine-3-carboxamide
CID 18712295
acetic acid;N-ethylpyridine-2-carboxamide
CID 174901243
4-(3-chloro-2-pyridinyl)-N-ethylbenzamide
CID 59673494
N-benzyl-2,4,5,6-tetrachloropyridine-3-carboxamide
CID 628678
N-ethyl-2-[3-(2-methoxyethyl)-4-oxopyrido[2,3-d]pyrimidin-2-yl]sulfanylacetamide
CID 38836757
N-[(4-chlorophenyl)methyl]-2-(3-ethyl-4-oxopyrido[2,3-d]pyrimidin-2-yl)sulfanylacetamide
CID 17462773
2-chloro-N-propylpyridine-3-carboxamide
CID 4286757
N-ethyl-1-methyl-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7619354
N-ethyl-2-[(2-methylpropan-2-yl)oxy]naphthalene-1-carboxamide
CID 19602319

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide (CID 91619436) is 2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide is CCNC(=O)c1c(Cl)nc2ncccc2c1Cl.
What is the InChIKey of 2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide?
The InChIKey is BHODTHNRJXBONE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Cl2N3O/c1-2-14-11(17)7-8(12)6-4-3-5-15-10(6)16-9(7)13/h3-5H,2H2,1H3,(H,14,17).
What are the key properties of 2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide?
2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide has a molecular weight of 270.12 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-ethyl-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 91619436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).