N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine

C16H26N2O — CID 164926766

IUPACN-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine
SMILESCCc1ccc([C@H]2CCOC2)c(CN(C)C(C)C)n1
InChIInChI=1S/C16H26N2O/c1-5-14-6-7-15(13-8-9-19-11-13)16(17-14)10-18(4)12(2)3/h6-7,12-13H,5,8-11H2,1-4H3/t13-/m0/s1
InChIKeyJXLBCJKLFDFESB-ZDUSSCGKSA-N
MW262.40 g/mol
LogP2.99
Rot. Bonds5

About N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine

N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine (PubChem CID 164926766) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine
PubChem CID164926766
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine
SMILESCCc1ccc([C@H]2CCOC2)c(CN(C)C(C)C)n1
InChIInChI=1S/C16H26N2O/c1-5-14-6-7-15(13-8-9-19-11-13)16(17-14)10-18(4)12(2)3/h6-7,12-13H,5,8-11H2,1-4H3/t13-/m0/s1
InChIKeyJXLBCJKLFDFESB-ZDUSSCGKSA-N
XLogP2.99
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine with MolForge

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Related Compounds

N-[[6-ethyl-3-(oxolan-3-yl)-2-pyridinyl]methyl]-2,2,2-trifluoro-N-methylethanamine
CID 156651300
1-cyclopropyl-N-[[6-ethyl-3-(oxolan-3-yl)-2-pyridinyl]methyl]methanamine
CID 156652076
6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]pyridin-2-amine
CID 178156266
[6-butan-2-yl-3-(oxolan-3-yl)-2-pyridinyl]methanamine
CID 165400069
N-[[6-butan-2-yl-3-[(3S)-oxolan-3-yl]-2-pyridinyl]methyl]-2-methoxy-N-methylethanamine
CID 156652222
ethane;2,2,2-trifluoro-N-methyl-N-[[6-methyl-3-(oxolan-3-yl)-2-pyridinyl]methyl]ethanamine
CID 172576226
N,N-dimethyl-1-[5-methyl-2-[(3R)-oxolan-3-yl]phenyl]methanamine
CID 165400243
[6-[(dimethylamino)methyl]-5-[(3R)-oxolan-3-yl]-2-pyridinyl] N-tert-butylcarbamate
CID 175330279
6-ethyl-2-(oxolan-3-yl)pyrimidin-4-amine
CID 62315273
2,2-difluoro-N-[[6-methylsulfanyl-3-(oxolan-3-yl)-2-pyridinyl]methyl]ethanamine
CID 166682571
1-cyclopropyl-N-[[6-methyl-3-(oxolan-3-yl)-2-pyridinyl]methyl]methanamine
CID 164926709
7-[[6-[(dimethylamino)methyl]-5-[(3S)-oxolan-3-yl]-2-pyridinyl]amino]-4-(2-methyl-4-pyridinyl)-2,3-dihydroisoindol-1-one
CID 176836675

Frequently Asked Questions

What is the IUPAC name of N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine?
The IUPAC name of N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine (CID 164926766) is N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine.
What is the SMILES notation for N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine?
The canonical SMILES for N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine is CCc1ccc([C@H]2CCOC2)c(CN(C)C(C)C)n1.
What is the InChIKey of N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine?
The InChIKey is JXLBCJKLFDFESB-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H26N2O/c1-5-14-6-7-15(13-8-9-19-11-13)16(17-14)10-18(4)12(2)3/h6-7,12-13H,5,8-11H2,1-4H3/t13-/m0/s1.
What are the key properties of N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine?
N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine has a molecular weight of 262.40 g/mol, XLogP of 2.99, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-ethyl-3-[(3R)-oxolan-3-yl]-2-pyridinyl]methyl]-N-methylpropan-2-amine is sourced from PubChem (CID 164926766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).