1-cyclooctyl-4-methylpyrrolidin-3-amine

C13H26N2 — CID 103575307

IUPAC1-cyclooctyl-4-methylpyrrolidin-3-amine
SMILESCC1CN(C2CCCCCCC2)CC1N
InChIInChI=1S/C13H26N2/c1-11-9-15(10-13(11)14)12-7-5-3-2-4-6-8-12/h11-13H,2-10,14H2,1H3
InChIKeyNURVVNGNAXGQQE-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.38
Rot. Bonds1

About 1-cyclooctyl-4-methylpyrrolidin-3-amine

1-cyclooctyl-4-methylpyrrolidin-3-amine (PubChem CID 103575307) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-cyclooctyl-4-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-cyclooctyl-4-methylpyrrolidin-3-amine
PubChem CID103575307
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name1-cyclooctyl-4-methylpyrrolidin-3-amine
SMILESCC1CN(C2CCCCCCC2)CC1N
InChIInChI=1S/C13H26N2/c1-11-9-15(10-13(11)14)12-7-5-3-2-4-6-8-12/h11-13H,2-10,14H2,1H3
InChIKeyNURVVNGNAXGQQE-UHFFFAOYSA-N
XLogP2.38
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S,4R)-1-cyclopropyl-4-methylpyrrolidin-3-amine
CID 124709446
4-methyl-1-(2-methylcyclohexyl)pyrrolidin-3-amine
CID 103575116
1-cyclodecyl-3-methylazetidine
CID 155016918
(3R,4R)-1-cyclohexyl-3,4-diethylpyrrolidine
CID 90238924
4-methyl-1-(1-propylpiperidin-4-yl)pyrrolidin-3-amine
CID 103575589
2-(3-amino-4-methylpyrrolidin-1-yl)cyclohexan-1-ol
CID 103576741
1-(4-tert-butylcycloheptyl)-3-methylpiperidin-4-amine
CID 79880572
1-(1-ethylazepan-4-yl)-4-methylpiperidin-3-amine
CID 65077439
3-tert-butyl-1-cyclohexylazetidine
CID 122606400
(2R,6R)-4-cyclohexyl-2,6-dimethylmorpholine
CID 23262067
1-cyclobutyl-3,5-dimethylpiperidin-4-ol
CID 170614269
1-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)-4-methylpyrrolidin-3-amine
CID 103575631

Frequently Asked Questions

What is the IUPAC name of 1-cyclooctyl-4-methylpyrrolidin-3-amine?
The IUPAC name of 1-cyclooctyl-4-methylpyrrolidin-3-amine (CID 103575307) is 1-cyclooctyl-4-methylpyrrolidin-3-amine.
What is the SMILES notation for 1-cyclooctyl-4-methylpyrrolidin-3-amine?
The canonical SMILES for 1-cyclooctyl-4-methylpyrrolidin-3-amine is CC1CN(C2CCCCCCC2)CC1N.
What is the InChIKey of 1-cyclooctyl-4-methylpyrrolidin-3-amine?
The InChIKey is NURVVNGNAXGQQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-11-9-15(10-13(11)14)12-7-5-3-2-4-6-8-12/h11-13H,2-10,14H2,1H3.
What are the key properties of 1-cyclooctyl-4-methylpyrrolidin-3-amine?
1-cyclooctyl-4-methylpyrrolidin-3-amine has a molecular weight of 210.36 g/mol, XLogP of 2.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclooctyl-4-methylpyrrolidin-3-amine is sourced from PubChem (CID 103575307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).