N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide

C17H21N5O — CID 112528726

IUPACN-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
SMILESCc1nc(C)c(CNC(=O)c2cncc3c2CCNC3)c(C)n1
InChIInChI=1S/C17H21N5O/c1-10-15(11(2)22-12(3)21-10)9-20-17(23)16-8-19-7-13-6-18-5-4-14(13)16/h7-8,18H,4-6,9H2,1-3H3,(H,20,23)
InChIKeyIDGLENLNUNUOSH-UHFFFAOYSA-N
MW311.39 g/mol
LogP1.37
Rot. Bonds3

About N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide

N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide (PubChem CID 112528726) has the molecular formula C17H21N5O and a molecular weight of 311.39 g/mol. Its IUPAC name is N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
PubChem CID112528726
Molecular FormulaC17H21N5O
Molecular Weight311.39 g/mol
Exact Mass311.17
IUPAC NameN-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
SMILESCc1nc(C)c(CNC(=O)c2cncc3c2CCNC3)c(C)n1
InChIInChI=1S/C17H21N5O/c1-10-15(11(2)22-12(3)21-10)9-20-17(23)16-8-19-7-13-6-18-5-4-14(13)16/h7-8,18H,4-6,9H2,1-3H3,(H,20,23)
InChIKeyIDGLENLNUNUOSH-UHFFFAOYSA-N
XLogP1.37
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide with MolForge

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Related Compounds

N-[(4-methylphenyl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
CID 112521808
N-methyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
CID 112520529
N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]pyridine-4-carboxamide
CID 56897206
N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-2,4-dioxo-1H-pyrimidine-5-carboxamide
CID 56916353
N-[2-(2-methoxyphenyl)ethyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
CID 112529278
N-cyclohexyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
CID 112520196
N-(2-methyl-1H-indol-5-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
CID 112526134
3,5-dimethyl-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-1,2-oxazole-4-carboxamide
CID 56914454
1-methyl-N-(5,6,7,8-tetrahydro-2,7-naphthyridin-4-ylmethyl)pyrazole-4-carboxamide
CID 97463912
3-hydroxy-4-methyl-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]benzamide
CID 56904541
N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-2-pyrrolidin-3-ylbenzamide
CID 56898601
5,7-dimethyl-N-[(3-methyl-5,6,7,8-tetrahydro-2,7-naphthyridin-4-yl)methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 56909513

Frequently Asked Questions

What is the IUPAC name of N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide?
The IUPAC name of N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide (CID 112528726) is N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide.
What is the SMILES notation for N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide?
The canonical SMILES for N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide is Cc1nc(C)c(CNC(=O)c2cncc3c2CCNC3)c(C)n1.
What is the InChIKey of N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide?
The InChIKey is IDGLENLNUNUOSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O/c1-10-15(11(2)22-12(3)21-10)9-20-17(23)16-8-19-7-13-6-18-5-4-14(13)16/h7-8,18H,4-6,9H2,1-3H3,(H,20,23).
What are the key properties of N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide?
N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide has a molecular weight of 311.39 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4,6-trimethylpyrimidin-5-yl)methyl]-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide is sourced from PubChem (CID 112528726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).