4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one

C9H10ClN3O — CID 145497399

IUPAC4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one
SMILESCCc1nc(Cl)c2c(n1)NC(=O)CC2
InChIInChI=1S/C9H10ClN3O/c1-2-6-11-8(10)5-3-4-7(14)13-9(5)12-6/h2-4H2,1H3,(H,11,12,13,14)
InChIKeyOHCXDPFDNRINCW-UHFFFAOYSA-N
MW211.65 g/mol
LogP1.58
Rot. Bonds1

About 4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one

4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one (PubChem CID 145497399) has the molecular formula C9H10ClN3O and a molecular weight of 211.65 g/mol. Its IUPAC name is 4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one.

Molecular Properties

Compound Name4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one
PubChem CID145497399
Molecular FormulaC9H10ClN3O
Molecular Weight211.65 g/mol
Exact Mass211.05
IUPAC Name4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one
SMILESCCc1nc(Cl)c2c(n1)NC(=O)CC2
InChIInChI=1S/C9H10ClN3O/c1-2-6-11-8(10)5-3-4-7(14)13-9(5)12-6/h2-4H2,1H3,(H,11,12,13,14)
InChIKeyOHCXDPFDNRINCW-UHFFFAOYSA-N
XLogP1.58
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.65
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-2-(dimethoxymethyl)-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one
CID 86628369
6-ethyl-7-(hydroxymethyl)-5-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one
CID 123965419
4-(6-chloro-2-ethyl-5-methylpyrimidin-4-yl)piperazine-2,6-dione
CID 80978472
4-chloro-2-methoxy-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one
CID 59419276
4-propyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one
CID 59421424
2-iodo-4-methyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one
CID 139502494
2-methyl-4-(trifluoromethyl)-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one
CID 14916841
2-ethyl-8H-pyrimido[5,4-b][1,4]oxazin-7-one
CID 57250075
5-ethyliodanuidyl-3,4-dihydro-1H-1,8-naphthyridin-2-one
CID 163523317
2-ethyl-8H-pyrimido[5,4-b][1,4]thiazin-7-one
CID 89082670
4-chloro-2-ethyl-5,6-dimethylpyrimidine
CID 21039945
4-chloro-2-ethyl-6-methylpyrimidine-5-carbaldehyde
CID 131075508

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one?
The IUPAC name of 4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one (CID 145497399) is 4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one.
What is the SMILES notation for 4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one?
The canonical SMILES for 4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one is CCc1nc(Cl)c2c(n1)NC(=O)CC2.
What is the InChIKey of 4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one?
The InChIKey is OHCXDPFDNRINCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClN3O/c1-2-6-11-8(10)5-3-4-7(14)13-9(5)12-6/h2-4H2,1H3,(H,11,12,13,14).
What are the key properties of 4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one?
4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one has a molecular weight of 211.65 g/mol, XLogP of 1.58, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-ethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidin-7-one is sourced from PubChem (CID 145497399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).