2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide

C18H22N4O2 — CID 156584807

IUPAC2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESCCc1[nH]c(=O)ccc1C(=O)NCCc1nc(C)c2c(n1)CCC2
InChIInChI=1S/C18H22N4O2/c1-3-14-13(7-8-17(23)22-14)18(24)19-10-9-16-20-11(2)12-5-4-6-15(12)21-16/h7-8H,3-6,9-10H2,1-2H3,(H,19,24)(H,22,23)
InChIKeyRWRCYMXGZIMWQZ-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.50
Rot. Bonds5

About 2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide

2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 156584807) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is 2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide
PubChem CID156584807
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC Name2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESCCc1[nH]c(=O)ccc1C(=O)NCCc1nc(C)c2c(n1)CCC2
InChIInChI=1S/C18H22N4O2/c1-3-14-13(7-8-17(23)22-14)18(24)19-10-9-16-20-11(2)12-5-4-6-15(12)21-16/h7-8H,3-6,9-10H2,1-2H3,(H,19,24)(H,22,23)
InChIKeyRWRCYMXGZIMWQZ-UHFFFAOYSA-N
XLogP1.50
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-4-oxo-3H-phthalazine-1-carboxamide
CID 131902037
5-ethoxy-N-[2-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)ethyl]furan-2-carboxamide
CID 91783712
5-ethyl-N-[2-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)ethyl]-1,3-oxazole-4-carboxamide
CID 29028743
N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-2-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 91772314
N-[2-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)ethyl]-3-(1,2,4-triazol-4-yl)-1H-1,2,4-triazole-5-carboxamide
CID 156586379
4,4,4-trifluoro-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]butanamide
CID 90650914
(1R)-2-methyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-3-phenylcycloprop-2-ene-1-carboxamide
CID 124755594
N-[2-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)ethyl]-3-(pyrazol-1-ylmethyl)benzamide
CID 50953115
(3R)-2-methyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CID 97195964
2-(1-ethyl-3-oxopiperazin-2-yl)-N-[2-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)ethyl]acetamide
CID 118784151
2-(2,3-dihydro-1H-inden-2-yl)-N-[2-(4-methyl-5,6,7,8-tetrahydroquinazolin-2-yl)ethyl]acetamide
CID 91834323
6-fluoro-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-2-oxo-3,4-dihydro-1H-quinoline-4-carboxamide
CID 70735481

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide (CID 156584807) is 2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide is CCc1[nH]c(=O)ccc1C(=O)NCCc1nc(C)c2c(n1)CCC2.
What is the InChIKey of 2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is RWRCYMXGZIMWQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c1-3-14-13(7-8-17(23)22-14)18(24)19-10-9-16-20-11(2)12-5-4-6-15(12)21-16/h7-8H,3-6,9-10H2,1-2H3,(H,19,24)(H,22,23).
What are the key properties of 2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide?
2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 1.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[2-(4-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 156584807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).