2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

C10H13N3O2 — CID 144833580

IUPAC2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESNC(=O)N1c2ncccc2CCC1CO
InChIInChI=1S/C10H13N3O2/c11-10(15)13-8(6-14)4-3-7-2-1-5-12-9(7)13/h1-2,5,8,14H,3-4,6H2,(H2,11,15)
InChIKeyRXTNRMMDCARKNS-UHFFFAOYSA-N
MW207.23 g/mol
LogP0.27
Rot. Bonds1

About 2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide

2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (PubChem CID 144833580) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.

Molecular Properties

Compound Name2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
PubChem CID144833580
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide
SMILESNC(=O)N1c2ncccc2CCC1CO
InChIInChI=1S/C10H13N3O2/c11-10(15)13-8(6-14)4-3-7-2-1-5-12-9(7)13/h1-2,5,8,14H,3-4,6H2,(H2,11,15)
InChIKeyRXTNRMMDCARKNS-UHFFFAOYSA-N
XLogP0.27
TPSA79.45 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The IUPAC name of 2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide (CID 144833580) is 2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide.
What is the SMILES notation for 2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The canonical SMILES for 2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is NC(=O)N1c2ncccc2CCC1CO.
What is the InChIKey of 2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
The InChIKey is RXTNRMMDCARKNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c11-10(15)13-8(6-14)4-3-7-2-1-5-12-9(7)13/h1-2,5,8,14H,3-4,6H2,(H2,11,15).
What are the key properties of 2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide?
2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide has a molecular weight of 207.23 g/mol, XLogP of 0.27, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(hydroxymethyl)-3,4-dihydro-2H-1,8-naphthyridine-1-carboxamide is sourced from PubChem (CID 144833580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).