N-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide

C16H24N2O2 — CID 145198243

IUPACN-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide
SMILESCC(=O)N(Cc1ccc(C(C)C)nc1)CC1CCCO1
InChIInChI=1S/C16H24N2O2/c1-12(2)16-7-6-14(9-17-16)10-18(13(3)19)11-15-5-4-8-20-15/h6-7,9,12,15H,4-5,8,10-11H2,1-3H3
InChIKeyULOPMNWCPVDWTP-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.73
Rot. Bonds5

About N-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide

N-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide (PubChem CID 145198243) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide
PubChem CID145198243
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide
SMILESCC(=O)N(Cc1ccc(C(C)C)nc1)CC1CCCO1
InChIInChI=1S/C16H24N2O2/c1-12(2)16-7-6-14(9-17-16)10-18(13(3)19)11-15-5-4-8-20-15/h6-7,9,12,15H,4-5,8,10-11H2,1-3H3
InChIKeyULOPMNWCPVDWTP-UHFFFAOYSA-N
XLogP2.73
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-methylphenyl)ethyl]-N-(oxolan-2-ylmethyl)acetamide
CID 71993848
N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]-N-(oxolan-2-ylmethyl)acetamide
CID 45199675
(2S)-2-amino-N-benzyl-N-(oxolan-2-ylmethyl)propanamide
CID 119302482
N-[(4-chlorophenyl)methyl]-N-[[(2S)-oxolan-2-yl]methyl]-2-(4-propan-2-ylphenoxy)acetamide
CID 42387343
N-(oxolan-2-ylmethyl)-2-(3-propan-2-ylphenoxy)-N-(pyridin-3-ylmethyl)acetamide
CID 55900794
[(2S)-oxolan-2-yl]methyl-(pyridin-4-ylmethyl)carbamic acid;hydrochloride
CID 66997327
N-[(4-fluorophenyl)methyl]-1-(oxolan-2-yl)-N-[(2-propan-2-ylpyrimidin-5-yl)methyl]methanamine
CID 46954471
(2S)-N-benzyl-2-methylsulfonyl-N-[[(2S)-oxolan-2-yl]methyl]propanamide
CID 97061654
4-amino-N-benzyl-N-(oxolan-2-ylmethyl)pentanamide
CID 120561181
N-[[(2S)-oxolan-2-yl]methyl]-5-propan-2-yl-N-(thiophen-3-ylmethyl)-1,2-oxazole-3-carboxamide
CID 95146887
2,4-dichloro-N-[(4-chlorophenyl)methyl]-N-(oxolan-2-ylmethyl)benzamide
CID 19118825
(2S)-2-(3-fluorophenoxy)-N-[[(2R)-oxolan-2-yl]methyl]-N-(pyridin-3-ylmethyl)propanamide
CID 94628652

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide?
The IUPAC name of N-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide (CID 145198243) is N-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide.
What is the SMILES notation for N-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide?
The canonical SMILES for N-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide is CC(=O)N(Cc1ccc(C(C)C)nc1)CC1CCCO1.
What is the InChIKey of N-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide?
The InChIKey is ULOPMNWCPVDWTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12(2)16-7-6-14(9-17-16)10-18(13(3)19)11-15-5-4-8-20-15/h6-7,9,12,15H,4-5,8,10-11H2,1-3H3.
What are the key properties of N-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide?
N-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.73, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)-N-[(6-propan-2-yl-3-pyridinyl)methyl]acetamide is sourced from PubChem (CID 145198243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).