ethane;1-ethylpyrrolidine;2-methylpropan-2-amine

C12H30N2 — CID 168977329

IUPACethane;1-ethylpyrrolidine;2-methylpropan-2-amine
SMILESCC.CC(C)(C)N.CCN1CCCC1
InChIInChI=1S/C6H13N.C4H11N.C2H6/c1-2-7-5-3-4-6-7;1-4(2,3)5;1-2/h2-6H2,1H3;5H2,1-3H3;1-2H3
InChIKeyCDBQMRIBGMWSOY-UHFFFAOYSA-N
MW202.39 g/mol
LogP2.87
Rot. Bonds1

About ethane;1-ethylpyrrolidine;2-methylpropan-2-amine

ethane;1-ethylpyrrolidine;2-methylpropan-2-amine (PubChem CID 168977329) has the molecular formula C12H30N2 and a molecular weight of 202.39 g/mol. Its IUPAC name is ethane;1-ethylpyrrolidine;2-methylpropan-2-amine.

Molecular Properties

Compound Nameethane;1-ethylpyrrolidine;2-methylpropan-2-amine
PubChem CID168977329
Molecular FormulaC12H30N2
Molecular Weight202.39 g/mol
Exact Mass202.24
IUPAC Nameethane;1-ethylpyrrolidine;2-methylpropan-2-amine
SMILESCC.CC(C)(C)N.CCN1CCCC1
InChIInChI=1S/C6H13N.C4H11N.C2H6/c1-2-7-5-3-4-6-7;1-4(2,3)5;1-2/h2-6H2,1H3;5H2,1-3H3;1-2H3
InChIKeyCDBQMRIBGMWSOY-UHFFFAOYSA-N
XLogP2.87
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.39
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze ethane;1-ethylpyrrolidine;2-methylpropan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Tert-butylpyrrolidine
CID 287918
2-Methyl-1-(pyrrolidin-1-yl)propan-2-amine
CID 2794701
(1-Tert-butylpyrrolidin-3-yl)methanamine
CID 24275282
2-Methyl-2-(pyrrolidin-1-yl)propan-1-amine
CID 9161357
4-(Pyrrolidin-1-yl)butan-2-amine
CID 11948311
2-Methyl-3-(pyrrolidin-1-yl)propan-1-amine
CID 17609129
1-Tert-butylpyrrolidin-3-amine
CID 20628330
3-(Pyrrolidin-1-yl)butan-1-amine
CID 23005513
2-Methyl-4-(pyrrolidin-1-yl)butan-2-amine
CID 59511247
(R)-1-(3-Fluoropyrrolidin-1-yl)-2-methylpropan-2-amine
CID 169903731
1-(3-Fluoropyrrolidin-1-yl)-2-methylpropan-2-amine
CID 83854042
N-tert-butyl-1-propylazaborolidin-2-amine
CID 85597056

Frequently Asked Questions

What is the IUPAC name of ethane;1-ethylpyrrolidine;2-methylpropan-2-amine?
The IUPAC name of ethane;1-ethylpyrrolidine;2-methylpropan-2-amine (CID 168977329) is ethane;1-ethylpyrrolidine;2-methylpropan-2-amine.
What is the SMILES notation for ethane;1-ethylpyrrolidine;2-methylpropan-2-amine?
The canonical SMILES for ethane;1-ethylpyrrolidine;2-methylpropan-2-amine is CC.CC(C)(C)N.CCN1CCCC1.
What is the InChIKey of ethane;1-ethylpyrrolidine;2-methylpropan-2-amine?
The InChIKey is CDBQMRIBGMWSOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N.C4H11N.C2H6/c1-2-7-5-3-4-6-7;1-4(2,3)5;1-2/h2-6H2,1H3;5H2,1-3H3;1-2H3.
What are the key properties of ethane;1-ethylpyrrolidine;2-methylpropan-2-amine?
ethane;1-ethylpyrrolidine;2-methylpropan-2-amine has a molecular weight of 202.39 g/mol, XLogP of 2.87, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethylpyrrolidine;2-methylpropan-2-amine is sourced from PubChem (CID 168977329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).