4-cyclohexyl-1-methylpyrrolidin-3-amine

C11H22N2 — CID 82407513

IUPAC4-cyclohexyl-1-methylpyrrolidin-3-amine
SMILESCN1CC(N)C(C2CCCCC2)C1
InChIInChI=1S/C11H22N2/c1-13-7-10(11(12)8-13)9-5-3-2-4-6-9/h9-11H,2-8,12H2,1H3
InChIKeyFBCKDUCZBBCBMU-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.46
Rot. Bonds1

About 4-cyclohexyl-1-methylpyrrolidin-3-amine

4-cyclohexyl-1-methylpyrrolidin-3-amine (PubChem CID 82407513) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 4-cyclohexyl-1-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name4-cyclohexyl-1-methylpyrrolidin-3-amine
PubChem CID82407513
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name4-cyclohexyl-1-methylpyrrolidin-3-amine
SMILESCN1CC(N)C(C2CCCCC2)C1
InChIInChI=1S/C11H22N2/c1-13-7-10(11(12)8-13)9-5-3-2-4-6-9/h9-11H,2-8,12H2,1H3
InChIKeyFBCKDUCZBBCBMU-UHFFFAOYSA-N
XLogP1.46
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopentyl-1,4-dimethylpyrrolidine
CID 155424989
(1S,5S)-3-methyl-3-azabicyclo[3.3.1]nonan-9-amine
CID 98086940
3-cyclobutyl-4-ethyl-1-methylpyrrolidine;ethane
CID 91585358
2-cyclohexylcycloheptan-1-amine
CID 62603079
trans-(1R,2R)-2-cyclohexylcyclopropan-1-amine;hydrochloride
CID 134690804
(3aS)-2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 142336980
2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 12847769
3-cycloheptyl-2-methylcyclopentan-1-amine
CID 82924217
ethane;2-methyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 91339086
4-ethyl-2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline
CID 154980100
(4aS,8aS)-2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-5-amine
CID 142824086
3-amino-4-cyclohexylpiperidine-1-carboxylic acid
CID 67192296

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-1-methylpyrrolidin-3-amine?
The IUPAC name of 4-cyclohexyl-1-methylpyrrolidin-3-amine (CID 82407513) is 4-cyclohexyl-1-methylpyrrolidin-3-amine.
What is the SMILES notation for 4-cyclohexyl-1-methylpyrrolidin-3-amine?
The canonical SMILES for 4-cyclohexyl-1-methylpyrrolidin-3-amine is CN1CC(N)C(C2CCCCC2)C1.
What is the InChIKey of 4-cyclohexyl-1-methylpyrrolidin-3-amine?
The InChIKey is FBCKDUCZBBCBMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-13-7-10(11(12)8-13)9-5-3-2-4-6-9/h9-11H,2-8,12H2,1H3.
What are the key properties of 4-cyclohexyl-1-methylpyrrolidin-3-amine?
4-cyclohexyl-1-methylpyrrolidin-3-amine has a molecular weight of 182.31 g/mol, XLogP of 1.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-1-methylpyrrolidin-3-amine is sourced from PubChem (CID 82407513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).