1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride

C14H18ClN5O — CID 86782037

IUPAC1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride
SMILESCCn1cc(C(=O)Nc2cnc3c(c2)CNCC3)cn1.Cl
InChIInChI=1S/C14H17N5O.ClH/c1-2-19-9-11(7-17-19)14(20)18-12-5-10-6-15-4-3-13(10)16-8-12;/h5,7-9,15H,2-4,6H2,1H3,(H,18,20);1H
InChIKeyQWJKLNBRQVUXGU-UHFFFAOYSA-N
MW307.79 g/mol
LogP1.62
Rot. Bonds3

About 1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride

1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride (PubChem CID 86782037) has the molecular formula C14H18ClN5O and a molecular weight of 307.79 g/mol. Its IUPAC name is 1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride
PubChem CID86782037
Molecular FormulaC14H18ClN5O
Molecular Weight307.79 g/mol
Exact Mass307.12
IUPAC Name1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride
SMILESCCn1cc(C(=O)Nc2cnc3c(c2)CNCC3)cn1.Cl
InChIInChI=1S/C14H17N5O.ClH/c1-2-19-9-11(7-17-19)14(20)18-12-5-10-6-15-4-3-13(10)16-8-12;/h5,7-9,15H,2-4,6H2,1H3,(H,18,20);1H
InChIKeyQWJKLNBRQVUXGU-UHFFFAOYSA-N
XLogP1.62
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.79
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride with MolForge

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Related Compounds

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CID 24898600
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CID 167375470
2-[4-[(1-ethylpyrazol-4-yl)carbamoyl]pyrazol-1-yl]acetic acid
CID 19500808
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CID 3249821
N-(1-benzylpyrazol-4-yl)-1-ethylpyrazole-4-carboxamide
CID 19395795
1-[(3,4-dichlorophenyl)methyl]-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-2-yl)pyrazole-4-carboxamide
CID 42597438
N-[1-[(4-methylphenyl)methyl]pyrazol-4-yl]-1,2,3,4-tetrahydroisoquinoline-6-carboxamide
CID 24898379
1-ethyl-N-[(4-methylpiperidin-4-yl)methyl]pyrazole-4-carboxamide
CID 99821300
N-[1-[(3-chlorophenoxy)methyl]pyrazol-4-yl]-1-ethylpyrazole-4-carboxamide
CID 19281175
3-[3-[(1-ethylpyrazole-4-carbonyl)amino]phenyl]benzoic acid
CID 167774425
1-ethyl-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]pyrazole-4-carboxamide
CID 19280974
4-amino-N-(1-ethylpyrazol-4-yl)benzamide
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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride?
The IUPAC name of 1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride (CID 86782037) is 1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride.
What is the SMILES notation for 1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride?
The canonical SMILES for 1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride is CCn1cc(C(=O)Nc2cnc3c(c2)CNCC3)cn1.Cl.
What is the InChIKey of 1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride?
The InChIKey is QWJKLNBRQVUXGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O.ClH/c1-2-19-9-11(7-17-19)14(20)18-12-5-10-6-15-4-3-13(10)16-8-12;/h5,7-9,15H,2-4,6H2,1H3,(H,18,20);1H.
What are the key properties of 1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride?
1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride has a molecular weight of 307.79 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)pyrazole-4-carboxamide;hydrochloride is sourced from PubChem (CID 86782037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).