N-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine

C16H26N2O — CID 79748191

IUPACN-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine
SMILESCCNC(Cc1ccc(CC)cn1)CC1CCCO1
InChIInChI=1S/C16H26N2O/c1-3-13-7-8-14(18-12-13)10-15(17-4-2)11-16-6-5-9-19-16/h7-8,12,15-17H,3-6,9-11H2,1-2H3
InChIKeyDXMSQQSWHHZKPD-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.73
Rot. Bonds7

About N-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine

N-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine (PubChem CID 79748191) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is N-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine
PubChem CID79748191
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC NameN-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine
SMILESCCNC(Cc1ccc(CC)cn1)CC1CCCO1
InChIInChI=1S/C16H26N2O/c1-3-13-7-8-14(18-12-13)10-15(17-4-2)11-16-6-5-9-19-16/h7-8,12,15-17H,3-6,9-11H2,1-2H3
InChIKeyDXMSQQSWHHZKPD-UHFFFAOYSA-N
XLogP2.73
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(5-ethylthiophen-2-yl)-3-(oxolan-2-yl)propan-2-amine
CID 62600752
1-(5-ethyl-2-pyridinyl)-4-(oxan-2-yl)butan-2-ol
CID 115822339
N-ethyl-1-(5-ethyl-2-pyridinyl)-4-methylpentan-2-amine
CID 79748669
1-(2,6-difluorophenyl)-N-ethyl-3-(oxolan-2-yl)propan-2-amine
CID 114931834
2-N-ethyl-3-(5-ethyl-2-pyridinyl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 79748096
N-ethyl-1-(oxolan-2-yl)butan-2-amine
CID 60820573
1-cyclobutyl-N-ethyl-3-(5-methyl-2-pyridinyl)propan-2-amine
CID 103164343
N-ethyl-4-(1-methylpyrazol-4-yl)-1-(oxolan-2-yl)butan-2-amine
CID 103009231
N-ethyl-1-(5-ethyl-2-pyridinyl)-4-propoxybutan-2-amine
CID 105168889
1-(5-bromo-3-pyridinyl)-N-ethyl-3-(oxan-2-yl)propan-2-amine
CID 104804014
N-ethyl-1-(5-ethyl-2-pyridinyl)-4-phenylbutan-2-amine
CID 79732693
1-(3-bromo-5-fluorophenyl)-N-ethyl-3-(oxolan-2-yl)propan-2-amine
CID 79708965

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine?
The IUPAC name of N-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine (CID 79748191) is N-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine.
What is the SMILES notation for N-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine?
The canonical SMILES for N-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine is CCNC(Cc1ccc(CC)cn1)CC1CCCO1.
What is the InChIKey of N-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine?
The InChIKey is DXMSQQSWHHZKPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-13-7-8-14(18-12-13)10-15(17-4-2)11-16-6-5-9-19-16/h7-8,12,15-17H,3-6,9-11H2,1-2H3.
What are the key properties of N-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine?
N-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine has a molecular weight of 262.40 g/mol, XLogP of 2.73, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-ethyl-2-pyridinyl)-3-(oxolan-2-yl)propan-2-amine is sourced from PubChem (CID 79748191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).