N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide

C15H22N2O2 — CID 91760229

IUPACN-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide
SMILESCN(CCCC1CCCO1)C(=O)Cc1cccnc1
InChIInChI=1S/C15H22N2O2/c1-17(9-3-6-14-7-4-10-19-14)15(18)11-13-5-2-8-16-12-13/h2,5,8,12,14H,3-4,6-7,9-11H2,1H3
InChIKeyHQCRWMRNOXDYKY-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.04
Rot. Bonds6

About N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide

N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide (PubChem CID 91760229) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide
PubChem CID91760229
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide
SMILESCN(CCCC1CCCO1)C(=O)Cc1cccnc1
InChIInChI=1S/C15H22N2O2/c1-17(9-3-6-14-7-4-10-19-14)15(18)11-13-5-2-8-16-12-13/h2,5,8,12,14H,3-4,6-7,9-11H2,1H3
InChIKeyHQCRWMRNOXDYKY-UHFFFAOYSA-N
XLogP2.04
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromopentyl)-N-methyl-2-pyridin-3-ylacetamide
CID 58870383
N-methyl-2-(2-methyl-3H-benzimidazol-5-yl)-N-[3-[(2S)-oxolan-2-yl]propyl]acetamide
CID 125161756
4-[methyl-(2-pyridin-3-ylacetyl)amino]butanoic acid
CID 62691218
N-methyl-4-(3-methyl-4-pyridinyl)-N-[3-(oxolan-2-yl)propyl]benzamide
CID 119067493
N-methyl-6-oxo-N-[3-[(2S)-oxolan-2-yl]propyl]-2-pyridin-3-yl-1H-pyrimidine-5-carboxamide
CID 97156070
3-(3-fluoro-4-pyridinyl)-N-methyl-N-[3-[(2S)-oxolan-2-yl]propyl]benzamide
CID 125159693
4-(4-fluorophenyl)-N-methyl-N-[3-(oxolan-2-yl)propyl]butanamide
CID 135108533
2-(4-fluorophenyl)-N-methyl-N-[2-(oxan-2-yl)ethyl]-3-pyridin-3-ylpropanamide
CID 110619177
N-methyl-N-(piperidin-4-ylmethyl)-2-pyridin-3-ylacetamide
CID 79715380
methyl 3-[methyl-(2-pyridin-3-ylacetyl)amino]propanoate
CID 62691426
oxolan-2-ylmethyl pyridine-3-carboxylate
CID 6260
N-[(1R,2R,3R)-2,3-dihydroxycycloheptyl]-N-methyl-2-pyridin-3-ylacetamide
CID 110125869

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide?
The IUPAC name of N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide (CID 91760229) is N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide?
The canonical SMILES for N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide is CN(CCCC1CCCO1)C(=O)Cc1cccnc1.
What is the InChIKey of N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide?
The InChIKey is HQCRWMRNOXDYKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-17(9-3-6-14-7-4-10-19-14)15(18)11-13-5-2-8-16-12-13/h2,5,8,12,14H,3-4,6-7,9-11H2,1H3.
What are the key properties of N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide?
N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide has a molecular weight of 262.35 g/mol, XLogP of 2.04, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[3-(oxolan-2-yl)propyl]-2-pyridin-3-ylacetamide is sourced from PubChem (CID 91760229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).