N-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide

C18H25N3O3 — CID 110226772

IUPACN-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide
SMILESCC(=O)NC(c1ccccn1)C1CCCN(C(=O)C2CCCO2)C1
InChIInChI=1S/C18H25N3O3/c1-13(22)20-17(15-7-2-3-9-19-15)14-6-4-10-21(12-14)18(23)16-8-5-11-24-16/h2-3,7,9,14,16-17H,4-6,8,10-12H2,1H3,(H,20,22)
InChIKeyKCFJFVJSBRZYLZ-UHFFFAOYSA-N
MW331.42 g/mol
LogP1.68
Rot. Bonds4

About N-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide

N-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide (PubChem CID 110226772) has the molecular formula C18H25N3O3 and a molecular weight of 331.42 g/mol. Its IUPAC name is N-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide.

Molecular Properties

Compound NameN-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide
PubChem CID110226772
Molecular FormulaC18H25N3O3
Molecular Weight331.42 g/mol
Exact Mass331.19
IUPAC NameN-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide
SMILESCC(=O)NC(c1ccccn1)C1CCCN(C(=O)C2CCCO2)C1
InChIInChI=1S/C18H25N3O3/c1-13(22)20-17(15-7-2-3-9-19-15)14-6-4-10-21(12-14)18(23)16-8-5-11-24-16/h2-3,7,9,14,16-17H,4-6,8,10-12H2,1H3,(H,20,22)
InChIKeyKCFJFVJSBRZYLZ-UHFFFAOYSA-N
XLogP1.68
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(R)-[(3R)-1-[2-(4-fluorophenyl)acetyl]piperidin-3-yl]-pyridin-2-ylmethyl]acetamide
CID 92550184
N-[(S)-[(3S)-1-[2-(2-methoxyphenyl)acetyl]piperidin-3-yl]-pyridin-2-ylmethyl]acetamide
CID 92550210
N-[(S)-[(3S)-1-[2-(3-methoxyphenyl)acetyl]piperidin-3-yl]-pyridin-2-ylmethyl]acetamide
CID 92550202
oxolan-2-yl-[4-(1-pyridin-2-ylethyl)piperazin-1-yl]methanone
CID 86844171
(3R)-3-acetamido-N-[(1R)-1-pyridin-2-ylethyl]piperidine-1-carboxamide
CID 95152686
(2S)-N-[(S)-[(3S)-1-[(4-methoxy-2,3-dimethylphenyl)methyl]piperidin-3-yl]-pyridin-2-ylmethyl]oxolane-2-carboxamide
CID 95795561
(2R)-N-[(R)-[(3S)-1-[(2-fluoro-3-methoxyphenyl)methyl]piperidin-3-yl]-pyridin-2-ylmethyl]oxolane-2-carboxamide
CID 124799837
(2R)-N-[(S)-[(3S)-1-[(2-pyrazol-1-ylphenyl)methyl]piperidin-3-yl]-pyridin-2-ylmethyl]oxolane-2-carboxamide
CID 124783014
[3-(methylamino)piperidin-1-yl]-[(2S)-oxolan-2-yl]methanone
CID 104856209
(2R)-N-[(1S)-2-methyl-1-pyridin-2-ylpropyl]oxolane-2-carboxamide
CID 96504930
3-[1-[(2S)-oxolane-2-carbonyl]piperidin-3-yl]butanoic acid
CID 104855870
2-cyclopentyl-N-[(R)-pyridin-2-yl-[(3R)-1-(1,2-thiazole-4-carbonyl)piperidin-3-yl]methyl]acetamide
CID 92577146

Frequently Asked Questions

What is the IUPAC name of N-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide?
The IUPAC name of N-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide (CID 110226772) is N-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide.
What is the SMILES notation for N-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide?
The canonical SMILES for N-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide is CC(=O)NC(c1ccccn1)C1CCCN(C(=O)C2CCCO2)C1.
What is the InChIKey of N-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide?
The InChIKey is KCFJFVJSBRZYLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O3/c1-13(22)20-17(15-7-2-3-9-19-15)14-6-4-10-21(12-14)18(23)16-8-5-11-24-16/h2-3,7,9,14,16-17H,4-6,8,10-12H2,1H3,(H,20,22).
What are the key properties of N-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide?
N-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide has a molecular weight of 331.42 g/mol, XLogP of 1.68, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(oxolane-2-carbonyl)piperidin-3-yl]-pyridin-2-ylmethyl]acetamide is sourced from PubChem (CID 110226772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).