N,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride

C17H25Cl2N5O3 — CID 119441526

IUPACN,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride
SMILESCc1cc(C(=O)N(C)C2CCNCC2)nc2c1c(=O)n(C)c(=O)n2C.Cl.Cl
InChIInChI=1S/C17H23N5O3.2ClH/c1-10-9-12(15(23)20(2)11-5-7-18-8-6-11)19-14-13(10)16(24)22(4)17(25)21(14)3;;/h9,11,18H,5-8H2,1-4H3;2*1H
InChIKeyRSNYYJPYFUJFSX-UHFFFAOYSA-N
MW418.33 g/mol
LogP0.61
Rot. Bonds2

About N,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride

N,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride (PubChem CID 119441526) has the molecular formula C17H25Cl2N5O3 and a molecular weight of 418.33 g/mol. Its IUPAC name is N,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride
PubChem CID119441526
Molecular FormulaC17H25Cl2N5O3
Molecular Weight418.33 g/mol
Exact Mass417.13
IUPAC NameN,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride
SMILESCc1cc(C(=O)N(C)C2CCNCC2)nc2c1c(=O)n(C)c(=O)n2C.Cl.Cl
InChIInChI=1S/C17H23N5O3.2ClH/c1-10-9-12(15(23)20(2)11-5-7-18-8-6-11)19-14-13(10)16(24)22(4)17(25)21(14)3;;/h9,11,18H,5-8H2,1-4H3;2*1H
InChIKeyRSNYYJPYFUJFSX-UHFFFAOYSA-N
XLogP0.61
TPSA89.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.33
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride?
The IUPAC name of N,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride (CID 119441526) is N,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride.
What is the SMILES notation for N,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride?
The canonical SMILES for N,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride is Cc1cc(C(=O)N(C)C2CCNCC2)nc2c1c(=O)n(C)c(=O)n2C.Cl.Cl.
What is the InChIKey of N,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride?
The InChIKey is RSNYYJPYFUJFSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O3.2ClH/c1-10-9-12(15(23)20(2)11-5-7-18-8-6-11)19-14-13(10)16(24)22(4)17(25)21(14)3;;/h9,11,18H,5-8H2,1-4H3;2*1H.
What are the key properties of N,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride?
N,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride has a molecular weight of 418.33 g/mol, XLogP of 0.61, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,1,3,5-tetramethyl-2,4-dioxo-N-piperidin-4-ylpyrido[2,3-d]pyrimidine-7-carboxamide;dihydrochloride is sourced from PubChem (CID 119441526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).