N-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide

C18H26N4O2 — CID 102559317

IUPACN-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide
SMILESCOc1ncnc2c1CN(C(=O)NC1CC1C1CCCCC1)CC2
InChIInChI=1S/C18H26N4O2/c1-24-17-14-10-22(8-7-15(14)19-11-20-17)18(23)21-16-9-13(16)12-5-3-2-4-6-12/h11-13,16H,2-10H2,1H3,(H,21,23)
InChIKeyWFIRCLVIZGEXRT-UHFFFAOYSA-N
MW330.43 g/mol
LogP2.52
Rot. Bonds3

About N-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide

N-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide (PubChem CID 102559317) has the molecular formula C18H26N4O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is N-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide.

Molecular Properties

Compound NameN-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide
PubChem CID102559317
Molecular FormulaC18H26N4O2
Molecular Weight330.43 g/mol
Exact Mass330.21
IUPAC NameN-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide
SMILESCOc1ncnc2c1CN(C(=O)NC1CC1C1CCCCC1)CC2
InChIInChI=1S/C18H26N4O2/c1-24-17-14-10-22(8-7-15(14)19-11-20-17)18(23)21-16-9-13(16)12-5-3-2-4-6-12/h11-13,16H,2-10H2,1H3,(H,21,23)
InChIKeyWFIRCLVIZGEXRT-UHFFFAOYSA-N
XLogP2.52
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide with MolForge

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Related Compounds

4-methoxy-5H,6H,7H,8H-pyrido[4,3-d]pyrimidine
CID 50989214
N-[(1-benzylcyclobutyl)methyl]-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide
CID 132295868
4-ethoxy-N-[2-(3-fluorophenyl)cyclopropyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide
CID 137989974
(3E)-1-(4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-[[(1-methylcyclopropyl)amino]-(methylideneamino)methylidene]-2-propan-2-ylidenepentan-1-one
CID 138665643
1-(4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-methyl-2-[(E)-1-[(1-methylcyclopropyl)amino]-1-(methylideneamino)prop-1-en-2-yl]but-2-en-1-one
CID 138665646
N-[4-[2-[4-(cyclohexylmethoxy)-2-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]ethyl]cyclohexyl]acetamide
CID 138671019
2-(4-Cyclopropyl-6-methoxypyrimidin-5-yl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine
CID 172584503
5,6,7,8-Tetrahydroquinazolin-4-yl piperazine-1-carboxylate
CID 175545110
(5S)-5-[(4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]pyrrolidin-2-one
CID 175900181
tert-butyl 4-piperidin-4-yloxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylate
CID 176924641
4-(cyclopropylamino)-2-(4-cyclopropyl-6-methoxypyrimidin-5-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carbonitrile
CID 177140916
3-[3-(4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)propyl]imidazolidine-2,4-dione
CID 53538462

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide?
The IUPAC name of N-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide (CID 102559317) is N-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide.
What is the SMILES notation for N-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide?
The canonical SMILES for N-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide is COc1ncnc2c1CN(C(=O)NC1CC1C1CCCCC1)CC2.
What is the InChIKey of N-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide?
The InChIKey is WFIRCLVIZGEXRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N4O2/c1-24-17-14-10-22(8-7-15(14)19-11-20-17)18(23)21-16-9-13(16)12-5-3-2-4-6-12/h11-13,16H,2-10H2,1H3,(H,21,23).
What are the key properties of N-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide?
N-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide has a molecular weight of 330.43 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylcyclopropyl)-4-methoxy-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide is sourced from PubChem (CID 102559317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).