6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride

C18H22ClN3O2 — CID 129111807

IUPAC6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride
SMILESCCOc1ccc(NC(=O)c2ccc3c(c2)CCC(N)C3)cn1.Cl
InChIInChI=1S/C18H21N3O2.ClH/c1-2-23-17-8-7-16(11-20-17)21-18(22)14-4-3-13-10-15(19)6-5-12(13)9-14;/h3-4,7-9,11,15H,2,5-6,10,19H2,1H3,(H,21,22);1H
InChIKeyRZQGUIIYAQOVIE-UHFFFAOYSA-N
MW347.85 g/mol
LogP2.97
Rot. Bonds4

About 6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride

6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride (PubChem CID 129111807) has the molecular formula C18H22ClN3O2 and a molecular weight of 347.85 g/mol. Its IUPAC name is 6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride
PubChem CID129111807
Molecular FormulaC18H22ClN3O2
Molecular Weight347.85 g/mol
Exact Mass347.14
IUPAC Name6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride
SMILESCCOc1ccc(NC(=O)c2ccc3c(c2)CCC(N)C3)cn1.Cl
InChIInChI=1S/C18H21N3O2.ClH/c1-2-23-17-8-7-16(11-20-17)21-18(22)14-4-3-13-10-15(19)6-5-12(13)9-14;/h3-4,7-9,11,15H,2,5-6,10,19H2,1H3,(H,21,22);1H
InChIKeyRZQGUIIYAQOVIE-UHFFFAOYSA-N
XLogP2.97
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.85
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride with MolForge

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Related Compounds

6-amino-N-(2-cyclopropylpyrimidin-5-yl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 162172495
[6-[(6-ethoxy-3-pyridinyl)carbamoyl]-1,2,3,4-tetrahydronaphthalen-2-yl]carbamic acid
CID 129111800
4-amino-N-(6-ethoxy-3-pyridinyl)-3-methoxybenzamide
CID 104783111
3-bromo-4-chloro-N-(6-ethoxy-3-pyridinyl)benzamide
CID 107999600
ethyl 7-amino-5,6,7,8-tetrahydronaphthalene-2-carboxylate;hydrochloride
CID 19386054
1-[(6S)-6-amino-5,6,7,8-tetrahydronaphthalen-2-yl]-3-(4-ethylphenyl)urea;hydrochloride
CID 129111805
1-cyclopropyl-3-(6-ethoxy-3-pyridinyl)urea
CID 115687753
6-amino-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
CID 23359820
6-ethoxy-N-(2-methoxypyrimidin-5-yl)pyridine-3-carboxamide
CID 122301635
N-[4-(2-amino-2-oxoethyl)phenyl]-6-ethoxypyridine-3-carboxamide
CID 87002406
3-amino-2-chloro-N-(6-ethoxy-3-pyridinyl)benzamide
CID 115930617
3,4,5-triethoxy-N-(6-methoxy-3-pyridinyl)benzamide
CID 7478549

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride?
The IUPAC name of 6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride (CID 129111807) is 6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride.
What is the SMILES notation for 6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride?
The canonical SMILES for 6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride is CCOc1ccc(NC(=O)c2ccc3c(c2)CCC(N)C3)cn1.Cl.
What is the InChIKey of 6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride?
The InChIKey is RZQGUIIYAQOVIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2.ClH/c1-2-23-17-8-7-16(11-20-17)21-18(22)14-4-3-13-10-15(19)6-5-12(13)9-14;/h3-4,7-9,11,15H,2,5-6,10,19H2,1H3,(H,21,22);1H.
What are the key properties of 6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride?
6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride has a molecular weight of 347.85 g/mol, XLogP of 2.97, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(6-ethoxy-3-pyridinyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide;hydrochloride is sourced from PubChem (CID 129111807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).