N-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride

C19H19ClN4O2 — CID 171689909

IUPACN-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride
SMILESCl.O=C(NCc1cncc2c1CCN(c1ccccn1)C2)c1ccco1
InChIInChI=1S/C19H18N4O2.ClH/c24-19(17-4-3-9-25-17)22-12-14-10-20-11-15-13-23(8-6-16(14)15)18-5-1-2-7-21-18;/h1-5,7,9-11H,6,8,12-13H2,(H,22,24);1H
InChIKeyKRGIMYFMSKDZBG-UHFFFAOYSA-N
MW370.84 g/mol
LogP2.98
Rot. Bonds4

About N-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride

N-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride (PubChem CID 171689909) has the molecular formula C19H19ClN4O2 and a molecular weight of 370.84 g/mol. Its IUPAC name is N-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride
PubChem CID171689909
Molecular FormulaC19H19ClN4O2
Molecular Weight370.84 g/mol
Exact Mass370.12
IUPAC NameN-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride
SMILESCl.O=C(NCc1cncc2c1CCN(c1ccccn1)C2)c1ccco1
InChIInChI=1S/C19H18N4O2.ClH/c24-19(17-4-3-9-25-17)22-12-14-10-20-11-15-13-23(8-6-16(14)15)18-5-1-2-7-21-18;/h1-5,7,9-11H,6,8,12-13H2,(H,22,24);1H
InChIKeyKRGIMYFMSKDZBG-UHFFFAOYSA-N
XLogP2.98
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.84
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride?
The IUPAC name of N-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride (CID 171689909) is N-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride?
The canonical SMILES for N-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride is Cl.O=C(NCc1cncc2c1CCN(c1ccccn1)C2)c1ccco1.
What is the InChIKey of N-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride?
The InChIKey is KRGIMYFMSKDZBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2.ClH/c24-19(17-4-3-9-25-17)22-12-14-10-20-11-15-13-23(8-6-16(14)15)18-5-1-2-7-21-18;/h1-5,7,9-11H,6,8,12-13H2,(H,22,24);1H.
What are the key properties of N-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride?
N-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride has a molecular weight of 370.84 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7-pyridin-2-yl-6,8-dihydro-5H-2,7-naphthyridin-4-yl)methyl]furan-2-carboxamide;hydrochloride is sourced from PubChem (CID 171689909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).