3-ethylpyrrolidine;methanamine

C7H18N2 — CID 19046047

IUPAC3-ethylpyrrolidine;methanamine
SMILESCCC1CCNC1.CN
InChIInChI=1S/C6H13N.CH5N/c1-2-6-3-4-7-5-6;1-2/h6-7H,2-5H2,1H3;2H2,1H3
InChIKeyAHOYFWIKYWXZCX-UHFFFAOYSA-N
MW130.23 g/mol
LogP0.58
Rot. Bonds1

About 3-ethylpyrrolidine;methanamine

3-ethylpyrrolidine;methanamine (PubChem CID 19046047) has the molecular formula C7H18N2 and a molecular weight of 130.23 g/mol. Its IUPAC name is 3-ethylpyrrolidine;methanamine.

Molecular Properties

Compound Name3-ethylpyrrolidine;methanamine
PubChem CID19046047
Molecular FormulaC7H18N2
Molecular Weight130.23 g/mol
Exact Mass130.15
IUPAC Name3-ethylpyrrolidine;methanamine
SMILESCCC1CCNC1.CN
InChIInChI=1S/C6H13N.CH5N/c1-2-6-3-4-7-5-6;1-2/h6-7H,2-5H2,1H3;2H2,1H3
InChIKeyAHOYFWIKYWXZCX-UHFFFAOYSA-N
XLogP0.58
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.23
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-Dimethyl-1-(pyrrolidin-3-yl)methanamine
CID 14086165
4-[2-(Pyrrolidin-1-yl)ethyl]piperidine
CID 296293
3-Propylpyrrolidine
CID 12648198
3,3-Diethylpyrrolidine
CID 19090605
N-(3-methylbutyl)pentane-1,5-diamine
CID 204875
3-Ethylpyrrolidine
CID 12648195
3-Methylpyrrolidine
CID 118158
3-Butylpyrrolidine
CID 17389761
2,3-Dimethylpyrrolidine
CID 21539078
3-Ethyl-3-methylpyrrolidine
CID 12691880
Methyl[(1-methylpyrrolidin-3-yl)methyl]amine
CID 15021556
4-(Pyrrolidin-1-ylmethyl)piperidine
CID 16768347

Frequently Asked Questions

What is the IUPAC name of 3-ethylpyrrolidine;methanamine?
The IUPAC name of 3-ethylpyrrolidine;methanamine (CID 19046047) is 3-ethylpyrrolidine;methanamine.
What is the SMILES notation for 3-ethylpyrrolidine;methanamine?
The canonical SMILES for 3-ethylpyrrolidine;methanamine is CCC1CCNC1.CN.
What is the InChIKey of 3-ethylpyrrolidine;methanamine?
The InChIKey is AHOYFWIKYWXZCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N.CH5N/c1-2-6-3-4-7-5-6;1-2/h6-7H,2-5H2,1H3;2H2,1H3.
What are the key properties of 3-ethylpyrrolidine;methanamine?
3-ethylpyrrolidine;methanamine has a molecular weight of 130.23 g/mol, XLogP of 0.58, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethylpyrrolidine;methanamine is sourced from PubChem (CID 19046047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).