3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine

C14H24N2O — CID 116759597

IUPAC3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine
SMILESCCOC(CC)(CC)C(N)Cc1cccnc1
InChIInChI=1S/C14H24N2O/c1-4-14(5-2,17-6-3)13(15)10-12-8-7-9-16-11-12/h7-9,11,13H,4-6,10,15H2,1-3H3
InChIKeyRSPUJJJCWYPQFS-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.55
Rot. Bonds7

About 3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine

3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine (PubChem CID 116759597) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine.

Molecular Properties

Compound Name3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine
PubChem CID116759597
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine
SMILESCCOC(CC)(CC)C(N)Cc1cccnc1
InChIInChI=1S/C14H24N2O/c1-4-14(5-2,17-6-3)13(15)10-12-8-7-9-16-11-12/h7-9,11,13H,4-6,10,15H2,1-3H3
InChIKeyRSPUJJJCWYPQFS-UHFFFAOYSA-N
XLogP2.55
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethoxy-3-ethyl-1-phenylpentan-2-amine
CID 116759543
3-methyl-1-pyridin-3-yl-3-pyrrolidin-1-ylpentan-2-amine
CID 104736500
(2S)-1-pyridin-3-ylbutan-2-amine
CID 93246137
4-(2-amino-3-ethoxy-3-ethylpentyl)pyridin-2-amine
CID 116759749
4-ethoxy-1-pyridin-3-ylbutan-2-amine
CID 112688280
3-(2,2-dimethoxyethyl)pyridine
CID 118705230
(2S)-4-methyl-1-pyridin-3-ylpentan-2-amine
CID 94470637
ethyl 2-fluoro-3-pyridin-3-ylpropanoate
CID 55265604
diethyl 2-(1-pyridin-3-ylpropan-2-yl)propanedioate
CID 67382967
3-ethyl-3-methoxy-1-pyridin-4-ylpentan-2-amine
CID 116760495
1-pyridin-3-ylundecan-2-amine
CID 62603230
1-amino-3-pyridin-3-ylpropan-2-ol
CID 56924494

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine?
The IUPAC name of 3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine (CID 116759597) is 3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine.
What is the SMILES notation for 3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine?
The canonical SMILES for 3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine is CCOC(CC)(CC)C(N)Cc1cccnc1.
What is the InChIKey of 3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine?
The InChIKey is RSPUJJJCWYPQFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-4-14(5-2,17-6-3)13(15)10-12-8-7-9-16-11-12/h7-9,11,13H,4-6,10,15H2,1-3H3.
What are the key properties of 3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine?
3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine has a molecular weight of 236.36 g/mol, XLogP of 2.55, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-3-ethyl-1-pyridin-3-ylpentan-2-amine is sourced from PubChem (CID 116759597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).