2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide

C17H20N4O2 — CID 143457033

IUPAC2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide
SMILESCc1ncccc1C(=O)Nc1ccc(NCC2CCCO2)nc1
InChIInChI=1S/C17H20N4O2/c1-12-15(5-2-8-18-12)17(22)21-13-6-7-16(19-10-13)20-11-14-4-3-9-23-14/h2,5-8,10,14H,3-4,9,11H2,1H3,(H,19,20)(H,21,22)
InChIKeyZHBCRTUYMIFKRF-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.63
Rot. Bonds5

About 2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide

2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide (PubChem CID 143457033) has the molecular formula C17H20N4O2 and a molecular weight of 312.37 g/mol. Its IUPAC name is 2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide
PubChem CID143457033
Molecular FormulaC17H20N4O2
Molecular Weight312.37 g/mol
Exact Mass312.16
IUPAC Name2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide
SMILESCc1ncccc1C(=O)Nc1ccc(NCC2CCCO2)nc1
InChIInChI=1S/C17H20N4O2/c1-12-15(5-2-8-18-12)17(22)21-13-6-7-16(19-10-13)20-11-14-4-3-9-23-14/h2,5-8,10,14H,3-4,9,11H2,1H3,(H,19,20)(H,21,22)
InChIKeyZHBCRTUYMIFKRF-UHFFFAOYSA-N
XLogP2.63
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]benzamide
CID 113025379
2-chloro-6-fluoro-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]benzamide
CID 113010626
4-amino-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]butanamide
CID 82034236
5-methyl-N-(oxolan-2-ylmethyl)pyridin-2-amine
CID 43104324
ethyl N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]carbamate
CID 113025422
2-(4-methoxyphenyl)-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]acetamide
CID 113010614
6-(oxolan-2-ylmethylamino)-N-[4-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 109153576
N-(oxolan-2-ylmethyl)-6-(oxolan-2-ylmethylamino)pyridine-3-carboxamide
CID 109153510
3-methyl-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]butanamide
CID 113025362
5-(oxolan-2-ylmethylamino)-N-phenylpyridine-2-carboxamide
CID 109185172
2-(4-methylphenoxy)-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]acetamide
CID 113025408
3,4,5-trimethoxy-N-[5-(oxolan-2-ylmethylamino)-2-pyridinyl]benzamide
CID 113025389

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide (CID 143457033) is 2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide is Cc1ncccc1C(=O)Nc1ccc(NCC2CCCO2)nc1.
What is the InChIKey of 2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide?
The InChIKey is ZHBCRTUYMIFKRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2/c1-12-15(5-2-8-18-12)17(22)21-13-6-7-16(19-10-13)20-11-14-4-3-9-23-14/h2,5-8,10,14H,3-4,9,11H2,1H3,(H,19,20)(H,21,22).
What are the key properties of 2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide?
2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 2.63, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[6-(oxolan-2-ylmethylamino)-3-pyridinyl]pyridine-3-carboxamide is sourced from PubChem (CID 143457033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).