1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide

C8H8N4O — CID 175026609

IUPAC1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide
SMILESNC(=O)c1cnc2c(c1)NC=NC2
InChIInChI=1S/C8H8N4O/c9-8(13)5-1-6-7(11-2-5)3-10-4-12-6/h1-2,4H,3H2,(H2,9,13)(H,10,12)
InChIKeyGJVKZWLOASBGHG-UHFFFAOYSA-N
MW176.18 g/mol
LogP0.13
Rot. Bonds1

About 1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide

1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide (PubChem CID 175026609) has the molecular formula C8H8N4O and a molecular weight of 176.18 g/mol. Its IUPAC name is 1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide.

Molecular Properties

Compound Name1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide
PubChem CID175026609
Molecular FormulaC8H8N4O
Molecular Weight176.18 g/mol
Exact Mass176.07
IUPAC Name1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide
SMILESNC(=O)c1cnc2c(c1)NC=NC2
InChIInChI=1S/C8H8N4O/c9-8(13)5-1-6-7(11-2-5)3-10-4-12-6/h1-2,4H,3H2,(H2,9,13)(H,10,12)
InChIKeyGJVKZWLOASBGHG-UHFFFAOYSA-N
XLogP0.13
TPSA80.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.18
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6,7-dihydro-5H-pyrrolo[3,4-b]pyridine-3-carboxamide
CID 154406419
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1,7-naphthyridine-3,6-dicarboxamide
CID 90953080
2,3-dihydro-[1,4]dioxino[2,3-b]pyridine-7-carboxamide
CID 144727603
acetamide;1,4-dihydroimidazol-5-one
CID 161387348
7-fluoroquinoline-3-carboxamide
CID 54200639
5-[(2S)-azetidin-2-yl]-6-chloropyridine-3-carboxamide
CID 131191374
1-methylpyrrolo[2,3-b]pyridine-5-carboxamide
CID 141014223
6-(azetidin-1-yl)-5-propan-2-ylpyridine-3-carboxamide
CID 134168196
8-piperazin-1-ylquinoline-3-carboxamide
CID 154407057
6-bromo-5-methoxypyridine-3-carboxamide
CID 122362558
9H-pyrido[2,3-b]indole-3-carboxamide
CID 69263092

Frequently Asked Questions

What is the IUPAC name of 1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide?
The IUPAC name of 1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide (CID 175026609) is 1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide.
What is the SMILES notation for 1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide?
The canonical SMILES for 1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide is NC(=O)c1cnc2c(c1)NC=NC2.
What is the InChIKey of 1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide?
The InChIKey is GJVKZWLOASBGHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O/c9-8(13)5-1-6-7(11-2-5)3-10-4-12-6/h1-2,4H,3H2,(H2,9,13)(H,10,12).
What are the key properties of 1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide?
1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide has a molecular weight of 176.18 g/mol, XLogP of 0.13, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dihydropyrido[3,2-d]pyrimidine-7-carboxamide is sourced from PubChem (CID 175026609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).