methyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride

C19H20ClN3O2 — CID 146063443

IUPACmethyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride
SMILESCCc1cccc(Nc2c(C(=O)OC)cnc3nc(C)ccc23)c1.Cl
InChIInChI=1S/C19H19N3O2.ClH/c1-4-13-6-5-7-14(10-13)22-17-15-9-8-12(2)21-18(15)20-11-16(17)19(23)24-3;/h5-11H,4H2,1-3H3,(H,20,21,22);1H
InChIKeyWCSIFBCCUHVVMF-UHFFFAOYSA-N
MW357.84 g/mol
LogP4.45
Rot. Bonds4

About methyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride

methyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride (PubChem CID 146063443) has the molecular formula C19H20ClN3O2 and a molecular weight of 357.84 g/mol. Its IUPAC name is methyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride.

Molecular Properties

Compound Namemethyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride
PubChem CID146063443
Molecular FormulaC19H20ClN3O2
Molecular Weight357.84 g/mol
Exact Mass357.12
IUPAC Namemethyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride
SMILESCCc1cccc(Nc2c(C(=O)OC)cnc3nc(C)ccc23)c1.Cl
InChIInChI=1S/C19H19N3O2.ClH/c1-4-13-6-5-7-14(10-13)22-17-15-9-8-12(2)21-18(15)20-11-16(17)19(23)24-3;/h5-11H,4H2,1-3H3,(H,20,21,22);1H
InChIKeyWCSIFBCCUHVVMF-UHFFFAOYSA-N
XLogP4.45
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.84
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

propyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate
CID 50836368
methyl 4-(3-fluoroanilino)-7-methyl-1,8-naphthyridine-3-carboxylate
CID 53132008
methyl 7-methyl-4-[3-(trifluoromethoxy)anilino]-1,8-naphthyridine-3-carboxylate
CID 53132058
methyl 4-(3,4-dimethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate
CID 53132016
methyl 4-(2-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate
CID 53132045
[4-(3-ethylanilino)-7-methyl-1,8-naphthyridin-3-yl]-(3-methylpiperidin-1-yl)methanone;hydrochloride
CID 146064141
methyl 4-(4-bromoanilino)-7-methyl-1,8-naphthyridine-3-carboxylate
CID 53132036
propan-2-yl 4-(4-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride
CID 146063613
methyl 4-(3-chloro-4-methoxyanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride
CID 146063412
[4-(3-ethylanilino)-7-methyl-1,8-naphthyridin-3-yl]-[(3R)-3-methylpiperidin-1-yl]methanone
CID 95092576
propyl 4-anilino-7-methyl-1,8-naphthyridine-3-carboxylate
CID 50836366
methyl 4-[(3-chlorophenyl)methylamino]-7-methyl-1,8-naphthyridine-3-carboxylate
CID 53131998

Frequently Asked Questions

What is the IUPAC name of methyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride?
The IUPAC name of methyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride (CID 146063443) is methyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride.
What is the SMILES notation for methyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride?
The canonical SMILES for methyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride is CCc1cccc(Nc2c(C(=O)OC)cnc3nc(C)ccc23)c1.Cl.
What is the InChIKey of methyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride?
The InChIKey is WCSIFBCCUHVVMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2.ClH/c1-4-13-6-5-7-14(10-13)22-17-15-9-8-12(2)21-18(15)20-11-16(17)19(23)24-3;/h5-11H,4H2,1-3H3,(H,20,21,22);1H.
What are the key properties of methyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride?
methyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride has a molecular weight of 357.84 g/mol, XLogP of 4.45, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-(3-ethylanilino)-7-methyl-1,8-naphthyridine-3-carboxylate;hydrochloride is sourced from PubChem (CID 146063443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).