(1-nonylpyrrolidin-2-yl)methanamine

C14H30N2 — CID 19780174

IUPAC(1-nonylpyrrolidin-2-yl)methanamine
SMILESCCCCCCCCCN1CCCC1CN
InChIInChI=1S/C14H30N2/c1-2-3-4-5-6-7-8-11-16-12-9-10-14(16)13-15/h14H,2-13,15H2,1H3
InChIKeySWQOEFGZUFXLBU-UHFFFAOYSA-N
MW226.41 g/mol
LogP3.16
Rot. Bonds9

About (1-nonylpyrrolidin-2-yl)methanamine

(1-nonylpyrrolidin-2-yl)methanamine (PubChem CID 19780174) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is (1-nonylpyrrolidin-2-yl)methanamine.

Molecular Properties

Compound Name(1-nonylpyrrolidin-2-yl)methanamine
PubChem CID19780174
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name(1-nonylpyrrolidin-2-yl)methanamine
SMILESCCCCCCCCCN1CCCC1CN
InChIInChI=1S/C14H30N2/c1-2-3-4-5-6-7-8-11-16-12-9-10-14(16)13-15/h14H,2-13,15H2,1H3
InChIKeySWQOEFGZUFXLBU-UHFFFAOYSA-N
XLogP3.16
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 53.16
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-dodecylpiperidin-2-yl)methanamine
CID 63405140
(1-dodecylazepan-2-yl)methanamine
CID 116640397
(1-butylazepan-2-yl)methanamine
CID 116640391
2-ethyl-1-undecylpyrrolidine
CID 171569857
3-(1-pentylpyrrolidin-2-yl)propan-1-amine
CID 63762476
(1-dodecylpyrrolidin-2-yl)methanol
CID 63468146
[(2R)-1-heptylpyrrolidin-2-yl]methanol
CID 64982587
[(2S)-1-decylpyrrolidin-2-yl]methanol
CID 79003239
1-decyl-2-propylpyrrolidine;hydrochloride
CID 175874875
2-(1-hexylpiperidin-2-yl)ethanamine
CID 63759699
1-dodecyl-2-ethylpiperidine
CID 171569899
2-butyl-1-dodecylpyrrolidine;formonitrile
CID 175874902

Frequently Asked Questions

What is the IUPAC name of (1-nonylpyrrolidin-2-yl)methanamine?
The IUPAC name of (1-nonylpyrrolidin-2-yl)methanamine (CID 19780174) is (1-nonylpyrrolidin-2-yl)methanamine.
What is the SMILES notation for (1-nonylpyrrolidin-2-yl)methanamine?
The canonical SMILES for (1-nonylpyrrolidin-2-yl)methanamine is CCCCCCCCCN1CCCC1CN.
What is the InChIKey of (1-nonylpyrrolidin-2-yl)methanamine?
The InChIKey is SWQOEFGZUFXLBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-2-3-4-5-6-7-8-11-16-12-9-10-14(16)13-15/h14H,2-13,15H2,1H3.
What are the key properties of (1-nonylpyrrolidin-2-yl)methanamine?
(1-nonylpyrrolidin-2-yl)methanamine has a molecular weight of 226.41 g/mol, XLogP of 3.16, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-nonylpyrrolidin-2-yl)methanamine is sourced from PubChem (CID 19780174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).