(6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid

C17H19N3O2 — CID 22335219

IUPAC(6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid
SMILESO=C(O)NCc1ccc2c(n1)CCN(Cc1ccccc1)C2
InChIInChI=1S/C17H19N3O2/c21-17(22)18-10-15-7-6-14-12-20(9-8-16(14)19-15)11-13-4-2-1-3-5-13/h1-7,18H,8-12H2,(H,21,22)
InChIKeyOLNAMOUVVYPTAC-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.41
Rot. Bonds4

About (6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid

(6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid (PubChem CID 22335219) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is (6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid.

Molecular Properties

Compound Name(6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid
PubChem CID22335219
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Name(6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid
SMILESO=C(O)NCc1ccc2c(n1)CCN(Cc1ccccc1)C2
InChIInChI=1S/C17H19N3O2/c21-17(22)18-10-15-7-6-14-12-20(9-8-16(14)19-15)11-13-4-2-1-3-5-13/h1-7,18H,8-12H2,(H,21,22)
InChIKeyOLNAMOUVVYPTAC-UHFFFAOYSA-N
XLogP2.41
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-benzyl-7,8-dihydro-5H-1,6-naphthyridine-2-carboxylic acid
CID 46839896
6-benzyl-2-(4-methylpiperazin-1-yl)-7,8-dihydro-5H-1,6-naphthyridine
CID 22335156
N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-methylpropanamide
CID 2388197
N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-phenylacetamide;hydrochloride
CID 44827183
2-(5-benzyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridin-1-yl)acetic acid
CID 82588919
N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-(2,3-dihydro-1H-inden-5-yl)acetamide
CID 8850262
2-amino-N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-phenylpropanamide
CID 119828595
N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)butanamide
CID 17453392
N-[2-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)amino]-2-oxoethyl]-2-methylbenzamide
CID 17437177
N-(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-methyl-2-[(2-phenylacetyl)amino]butanamide
CID 112794431
6-benzyl-2-methylsulfanyl-5,7,8,9-tetrahydropyrido[3,2-c]azepine
CID 70857995
N-(6-benzyl-4,5,7,8-tetrahydro-[1,3]thiazolo[4,5-d]azepin-2-yl)acetamide
CID 19985779

Frequently Asked Questions

What is the IUPAC name of (6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid?
The IUPAC name of (6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid (CID 22335219) is (6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid.
What is the SMILES notation for (6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid?
The canonical SMILES for (6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid is O=C(O)NCc1ccc2c(n1)CCN(Cc1ccccc1)C2.
What is the InChIKey of (6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid?
The InChIKey is OLNAMOUVVYPTAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c21-17(22)18-10-15-7-6-14-12-20(9-8-16(14)19-15)11-13-4-2-1-3-5-13/h1-7,18H,8-12H2,(H,21,22).
What are the key properties of (6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid?
(6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid has a molecular weight of 297.36 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-benzyl-7,8-dihydro-5H-1,6-naphthyridin-2-yl)methylcarbamic acid is sourced from PubChem (CID 22335219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).