2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine

C12H24N2 — CID 62615480

IUPAC2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine
SMILESCC1CCN(CC2CCCCC2N)C1
InChIInChI=1S/C12H24N2/c1-10-6-7-14(8-10)9-11-4-2-3-5-12(11)13/h10-12H,2-9,13H2,1H3
InChIKeyPGFXZEKMJOQKJJ-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.85
Rot. Bonds2

About 2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine

2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine (PubChem CID 62615480) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine
PubChem CID62615480
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine
SMILESCC1CCN(CC2CCCCC2N)C1
InChIInChI=1S/C12H24N2/c1-10-6-7-14(8-10)9-11-4-2-3-5-12(11)13/h10-12H,2-9,13H2,1H3
InChIKeyPGFXZEKMJOQKJJ-UHFFFAOYSA-N
XLogP1.85
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Cyclohexylpyrrolidine
CID 4637746
3-(1-Methylpyrrolidin-2-yl)piperidine
CID 219458
1-methyl-N-(2-methylcyclohexyl)piperidin-4-amine
CID 2846586
2-[(Diethylamino)methyl]cyclohexan-1-amine
CID 23009041
2-[(Dimethylamino)methyl]cyclohexan-1-amine
CID 23009040
4-(1-Methylpyrrolidin-2-yl)piperidine
CID 66272593
1-Methyl-1-azaspiro[4.5]decan-4-amine
CID 13282860
(3S)-6-methyl-6-azabicyclo[3.2.1]octan-3-amine
CID 44385446
(3R)-6-methyl-6-azabicyclo[3.2.1]octan-3-amine
CID 44386431
N-(2-methylcyclohexyl)pyrrolidine
CID 12218077
1-Methyl-3-(pyrrolidin-2-yl)piperidine
CID 4020197
(2-(Pyrrolidin-1-yl)cyclohexyl)methanamine dihydrochloride
CID 132300860

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine (CID 62615480) is 2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine is CC1CCN(CC2CCCCC2N)C1.
What is the InChIKey of 2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine?
The InChIKey is PGFXZEKMJOQKJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-10-6-7-14(8-10)9-11-4-2-3-5-12(11)13/h10-12H,2-9,13H2,1H3.
What are the key properties of 2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine?
2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine has a molecular weight of 196.34 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 62615480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).