(3-ethylpyrrolidin-1-yl)methanamine

C7H16N2 — CID 57317446

IUPAC(3-ethylpyrrolidin-1-yl)methanamine
SMILESCCC1CCN(CN)C1
InChIInChI=1S/C7H16N2/c1-2-7-3-4-9(5-7)6-8/h7H,2-6,8H2,1H3
InChIKeyIDIPWNKNQJFZNF-UHFFFAOYSA-N
MW128.22 g/mol
LogP0.63
Rot. Bonds2

About (3-ethylpyrrolidin-1-yl)methanamine

(3-ethylpyrrolidin-1-yl)methanamine (PubChem CID 57317446) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is (3-ethylpyrrolidin-1-yl)methanamine.

Molecular Properties

Compound Name(3-ethylpyrrolidin-1-yl)methanamine
PubChem CID57317446
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC Name(3-ethylpyrrolidin-1-yl)methanamine
SMILESCCC1CCN(CN)C1
InChIInChI=1S/C7H16N2/c1-2-7-3-4-9(5-7)6-8/h7H,2-6,8H2,1H3
InChIKeyIDIPWNKNQJFZNF-UHFFFAOYSA-N
XLogP0.63
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-diethylpyrrolidine;ethane
CID 145103245
1,3-diethylpyrrolidine;formonitrile
CID 175874911
1,3-diethylpyrrolidine;ethane;molecular hydrogen
CID 143628979
N'-[2-(3-ethylpyrrolidin-1-yl)ethyl]ethane-1,2-diamine
CID 143093891
1-(2,2-difluoroethyl)-3-ethylpyrrolidine;ethane
CID 169182399
3-(3-ethylpyrrolidin-1-yl)propan-1-ol
CID 67281983
2-[(3R)-3-ethylpiperidin-1-yl]ethanamine
CID 93187820
3-ethyl-1-[(4-methylphenyl)methyl]pyrrolidine
CID 144719735
ethyl 2-(3-ethylpyrrolidin-1-yl)acetate
CID 115688617
1-(3-ethylpyrrolidin-1-yl)butan-2-ol
CID 115688740
6-(3-ethylpyrrolidin-1-yl)hexan-1-ol
CID 103748114
3-ethyl-1-methylpyrrolidine;methane
CID 161184146

Frequently Asked Questions

What is the IUPAC name of (3-ethylpyrrolidin-1-yl)methanamine?
The IUPAC name of (3-ethylpyrrolidin-1-yl)methanamine (CID 57317446) is (3-ethylpyrrolidin-1-yl)methanamine.
What is the SMILES notation for (3-ethylpyrrolidin-1-yl)methanamine?
The canonical SMILES for (3-ethylpyrrolidin-1-yl)methanamine is CCC1CCN(CN)C1.
What is the InChIKey of (3-ethylpyrrolidin-1-yl)methanamine?
The InChIKey is IDIPWNKNQJFZNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2/c1-2-7-3-4-9(5-7)6-8/h7H,2-6,8H2,1H3.
What are the key properties of (3-ethylpyrrolidin-1-yl)methanamine?
(3-ethylpyrrolidin-1-yl)methanamine has a molecular weight of 128.22 g/mol, XLogP of 0.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylpyrrolidin-1-yl)methanamine is sourced from PubChem (CID 57317446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).