2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine

C10H15N3O — CID 105447306

IUPAC2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
SMILESCCc1nc2c(c(OC)n1)CCNC2
InChIInChI=1S/C10H15N3O/c1-3-9-12-8-6-11-5-4-7(8)10(13-9)14-2/h11H,3-6H2,1-2H3
InChIKeyCYQTYFHQOZYVGA-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.69
Rot. Bonds2

About 2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine

2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine (PubChem CID 105447306) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine.

Molecular Properties

Compound Name2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
PubChem CID105447306
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
SMILESCCc1nc2c(c(OC)n1)CCNC2
InChIInChI=1S/C10H15N3O/c1-3-9-12-8-6-11-5-4-7(8)10(13-9)14-2/h11H,3-6H2,1-2H3
InChIKeyCYQTYFHQOZYVGA-UHFFFAOYSA-N
XLogP0.69
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-2-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
CID 115025312
N,N-diethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-amine
CID 105498037
2-ethyl-N,N-dimethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine
CID 105459654
N,N,2-triethyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine
CID 105495360
2-ethyl-4-(trifluoromethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
CID 66969843
2-(4-methoxy-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)acetic acid
CID 83891041
2,4-dipropyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
CID 114742569
N,N-diethyl-4-methoxy-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-2-amine
CID 117101191
2-(1,3-dihydroisoindol-2-yl)-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
CID 117100971
1-[1-[(4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-yl)oxymethyl]cyclopropyl]-N,N-dimethylmethanamine
CID 164799166
2-cyclopropyl-4-ethoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
CID 105474414
2-(2-methoxypropyl)-4-methyl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine
CID 114742173

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine?
The IUPAC name of 2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine (CID 105447306) is 2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine.
What is the SMILES notation for 2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine?
The canonical SMILES for 2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine is CCc1nc2c(c(OC)n1)CCNC2.
What is the InChIKey of 2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine?
The InChIKey is CYQTYFHQOZYVGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-3-9-12-8-6-11-5-4-7(8)10(13-9)14-2/h11H,3-6H2,1-2H3.
What are the key properties of 2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine?
2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine has a molecular weight of 193.25 g/mol, XLogP of 0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-methoxy-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidine is sourced from PubChem (CID 105447306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).