2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol

C12H26N2O2 — CID 103540741

IUPAC2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol
SMILESCCNC(C)(CO)CCN1CCC(OC)C1
InChIInChI=1S/C12H26N2O2/c1-4-13-12(2,10-15)6-8-14-7-5-11(9-14)16-3/h11,13,15H,4-10H2,1-3H3
InChIKeyFKLGGLZHCYJGBL-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.46
Rot. Bonds7

About 2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol

2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol (PubChem CID 103540741) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol.

Molecular Properties

Compound Name2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol
PubChem CID103540741
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol
SMILESCCNC(C)(CO)CCN1CCC(OC)C1
InChIInChI=1S/C12H26N2O2/c1-4-13-12(2,10-15)6-8-14-7-5-11(9-14)16-3/h11,13,15H,4-10H2,1-3H3
InChIKeyFKLGGLZHCYJGBL-UHFFFAOYSA-N
XLogP0.46
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-5-(3-methoxypiperidin-1-yl)-2-methylpentan-1-ol
CID 102968965
4-(3-methoxypiperidin-1-yl)-2-methyl-2-(propylamino)butan-1-ol
CID 102968930
4-(3,4-dimethoxypyrrolidin-1-yl)-2-(ethylamino)-2-methylbutan-1-ol
CID 103540799
4-[3-(dimethylamino)pyrrolidin-1-yl]-2-(ethylamino)-2-methylbutan-1-ol
CID 64791718
2-(ethylamino)-2-methyl-4-(3-pyrrolidin-1-ylpyrrolidin-1-yl)butan-1-ol
CID 64791863
6-(3-methoxypiperidin-1-yl)-2-methyl-2-(propylamino)hexan-1-ol
CID 102968939
N-[2-(3-methoxypyrrolidin-1-yl)ethyl]-2-methylpropan-2-amine
CID 103532099
ethyl 2-(ethylamino)-6-(3-methoxypyrrolidin-1-yl)-2-methylhexanoate
CID 103538059
2-methyl-4-(3-methylpyrrolidin-1-yl)-2-(propylamino)butan-1-ol
CID 64825876
2-ethyl-2-(ethylamino)-5-(3-methoxypyrrolidin-1-yl)pentanoic acid
CID 106806557
3-(3-methoxypyrrolidin-1-yl)-2,2-dimethylpropan-1-ol
CID 103539225
N-ethyl-2-(3-methoxypyrrolidin-1-yl)ethanamine
CID 103532306

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol?
The IUPAC name of 2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol (CID 103540741) is 2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol.
What is the SMILES notation for 2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol?
The canonical SMILES for 2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol is CCNC(C)(CO)CCN1CCC(OC)C1.
What is the InChIKey of 2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol?
The InChIKey is FKLGGLZHCYJGBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-4-13-12(2,10-15)6-8-14-7-5-11(9-14)16-3/h11,13,15H,4-10H2,1-3H3.
What are the key properties of 2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol?
2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol has a molecular weight of 230.35 g/mol, XLogP of 0.46, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-4-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-ol is sourced from PubChem (CID 103540741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).