1-(1-nonylpyrrolidin-3-yl)ethanamine

C15H32N2 — CID 113360760

IUPAC1-(1-nonylpyrrolidin-3-yl)ethanamine
SMILESCCCCCCCCCN1CCC(C(C)N)C1
InChIInChI=1S/C15H32N2/c1-3-4-5-6-7-8-9-11-17-12-10-15(13-17)14(2)16/h14-15H,3-13,16H2,1-2H3
InChIKeyWGMXMQYZQHGLNJ-UHFFFAOYSA-N
MW240.43 g/mol
LogP3.41
Rot. Bonds9

About 1-(1-nonylpyrrolidin-3-yl)ethanamine

1-(1-nonylpyrrolidin-3-yl)ethanamine (PubChem CID 113360760) has the molecular formula C15H32N2 and a molecular weight of 240.43 g/mol. Its IUPAC name is 1-(1-nonylpyrrolidin-3-yl)ethanamine.

Molecular Properties

Compound Name1-(1-nonylpyrrolidin-3-yl)ethanamine
PubChem CID113360760
Molecular FormulaC15H32N2
Molecular Weight240.43 g/mol
Exact Mass240.26
IUPAC Name1-(1-nonylpyrrolidin-3-yl)ethanamine
SMILESCCCCCCCCCN1CCC(C(C)N)C1
InChIInChI=1S/C15H32N2/c1-3-4-5-6-7-8-9-11-17-12-10-15(13-17)14(2)16/h14-15H,3-13,16H2,1-2H3
InChIKeyWGMXMQYZQHGLNJ-UHFFFAOYSA-N
XLogP3.41
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.43
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(1-hexylpiperidin-4-yl)ethanamine
CID 63595820
1-(1-propylpyrrolidin-3-yl)ethanamine
CID 83981022
1-decyl-4-propan-2-ylpiperidine
CID 166461232
(3S)-1-heptylpyrrolidin-3-amine
CID 81491543
(3S)-1-nonylpyrrolidin-3-amine
CID 115302510
1-(1-heptylpiperidin-4-yl)ethanol
CID 103688705
4-(1-bromoethyl)-1-heptylpiperidine
CID 106838196
1-hexyl-3-(2-methylpropyl)pyrrolidine
CID 169242044
1-hexyl-4-(2-methylpropyl)piperidine
CID 157305841
6-(4-propan-2-ylpiperidin-1-yl)hexan-3-amine
CID 106800167
1-[1-(5-aminopentyl)pyrrolidin-3-yl]ethanol
CID 112624715
(3S)-1-butyl-3-(difluoromethyl)pyrrolidine
CID 175738561

Frequently Asked Questions

What is the IUPAC name of 1-(1-nonylpyrrolidin-3-yl)ethanamine?
The IUPAC name of 1-(1-nonylpyrrolidin-3-yl)ethanamine (CID 113360760) is 1-(1-nonylpyrrolidin-3-yl)ethanamine.
What is the SMILES notation for 1-(1-nonylpyrrolidin-3-yl)ethanamine?
The canonical SMILES for 1-(1-nonylpyrrolidin-3-yl)ethanamine is CCCCCCCCCN1CCC(C(C)N)C1.
What is the InChIKey of 1-(1-nonylpyrrolidin-3-yl)ethanamine?
The InChIKey is WGMXMQYZQHGLNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2/c1-3-4-5-6-7-8-9-11-17-12-10-15(13-17)14(2)16/h14-15H,3-13,16H2,1-2H3.
What are the key properties of 1-(1-nonylpyrrolidin-3-yl)ethanamine?
1-(1-nonylpyrrolidin-3-yl)ethanamine has a molecular weight of 240.43 g/mol, XLogP of 3.41, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-nonylpyrrolidin-3-yl)ethanamine is sourced from PubChem (CID 113360760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).