5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione

C16H24N4O2 — CID 16845061

IUPAC5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCCCCN(CC)c1c(C)cnc2c1c(=O)n(C)c(=O)n2C
InChIInChI=1S/C16H24N4O2/c1-6-8-9-20(7-2)13-11(3)10-17-14-12(13)15(21)19(5)16(22)18(14)4/h10H,6-9H2,1-5H3
InChIKeySFPBTPKMWWZSHR-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.57
Rot. Bonds5

About 5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione

5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 16845061) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is 5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID16845061
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC Name5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCCCCN(CC)c1c(C)cnc2c1c(=O)n(C)c(=O)n2C
InChIInChI=1S/C16H24N4O2/c1-6-8-9-20(7-2)13-11(3)10-17-14-12(13)15(21)19(5)16(22)18(14)4/h10H,6-9H2,1-5H3
InChIKeySFPBTPKMWWZSHR-UHFFFAOYSA-N
XLogP1.57
TPSA60.13 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5-[bis(2-methoxyethyl)amino]-6-ethyl-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
CID 16845239
2-(1,3,6-trimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-5-yl)sulfanylacetamide
CID 41084970
2-ethyl-N-(1,3,6-trimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-5-yl)butanamide
CID 16840693
5-(2-methoxyethylamino)-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione
CID 16802512
5-bromo-6-chloro-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
CID 114764119
6-[2-aminoethyl(butyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
CID 55242367
7-[hexyl(methyl)amino]-1,3-dimethylpurine-2,6-dione
CID 146403548
2-(1,3-dimethyl-2,4-dioxo-6-propylpyrido[2,3-d]pyrimidin-5-yl)sulfanyl-N,N-diethylacetamide
CID 7424401
1,3,6-trimethyl-5-(3-propan-2-yloxypropylamino)pyrido[2,3-d]pyrimidine-2,4-dione
CID 16845089
3,3-dimethyl-N-(1,3,6-trimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-5-yl)butanamide
CID 16840692
5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione
CID 16845076
3-chloro-2,2-dimethyl-N-(1,3,6-trimethyl-2,4-dioxopyrido[2,3-d]pyrimidin-5-yl)propanamide
CID 16840710

Frequently Asked Questions

What is the IUPAC name of 5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione (CID 16845061) is 5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione is CCCCN(CC)c1c(C)cnc2c1c(=O)n(C)c(=O)n2C.
What is the InChIKey of 5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is SFPBTPKMWWZSHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-6-8-9-20(7-2)13-11(3)10-17-14-12(13)15(21)19(5)16(22)18(14)4/h10H,6-9H2,1-5H3.
What are the key properties of 5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione?
5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 304.39 g/mol, XLogP of 1.57, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[butyl(ethyl)amino]-1,3,6-trimethylpyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 16845061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).