[3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine

C14H28N2 — CID 64746034

IUPAC[3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine
SMILESCC1CCC(CN)(N2CCCC2C)CC1C
InChIInChI=1S/C14H28N2/c1-11-6-7-14(10-15,9-12(11)2)16-8-4-5-13(16)3/h11-13H,4-10,15H2,1-3H3
InChIKeyJHABRTQDZUVDAE-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.62
Rot. Bonds2

About [3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine

[3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine (PubChem CID 64746034) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is [3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine
PubChem CID64746034
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name[3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine
SMILESCC1CCC(CN)(N2CCCC2C)CC1C
InChIInChI=1S/C14H28N2/c1-11-6-7-14(10-15,9-12(11)2)16-8-4-5-13(16)3/h11-13H,4-10,15H2,1-3H3
InChIKeyJHABRTQDZUVDAE-UHFFFAOYSA-N
XLogP2.62
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-methyl-1-(2-methylpiperidin-1-yl)cyclohexyl]methanamine
CID 43176277
[1-(2-methylpiperidin-1-yl)cyclohexyl]methanamine
CID 24697145
[1,5-dimethyl-3-(2-methylazepan-1-yl)pyrrolidin-3-yl]methanamine
CID 81467694
[3-methoxy-1-(2-methylpiperidin-1-yl)cyclobutyl]methanamine
CID 106821667
[1-(2-ethyl-5-methylpyrrolidin-1-yl)-3,4-dimethylcyclohexyl]methanamine
CID 83226884
[1-(4-ethylpiperazin-1-yl)-3,4-dimethylcyclohexyl]methanamine
CID 64745247
[1-(2,3-dimethylpiperidin-1-yl)-4-methylcyclohexyl]methanamine
CID 55040418
[1-(2-methylazepan-1-yl)-4-propan-2-ylcycloheptyl]methanamine
CID 65089102
[4-(2-methylbutan-2-yl)-1-(2-methylpiperidin-1-yl)cyclohexyl]methanamine
CID 43080296
[3,4-dimethyl-1-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)cyclohexyl]methanamine
CID 81199459
[3-(2-methylpiperidin-1-yl)-1,1-dioxothiolan-3-yl]methanamine
CID 63162443
[1,2-dimethyl-4-(2-propylpiperidin-1-yl)piperidin-4-yl]methanamine
CID 83052147

Frequently Asked Questions

What is the IUPAC name of [3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine?
The IUPAC name of [3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine (CID 64746034) is [3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine.
What is the SMILES notation for [3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine?
The canonical SMILES for [3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine is CC1CCC(CN)(N2CCCC2C)CC1C.
What is the InChIKey of [3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine?
The InChIKey is JHABRTQDZUVDAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-11-6-7-14(10-15,9-12(11)2)16-8-4-5-13(16)3/h11-13H,4-10,15H2,1-3H3.
What are the key properties of [3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine?
[3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine has a molecular weight of 224.39 g/mol, XLogP of 2.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3,4-dimethyl-1-(2-methylpyrrolidin-1-yl)cyclohexyl]methanamine is sourced from PubChem (CID 64746034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).