3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine

C12H24N2 — CID 106636915

IUPAC3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
SMILESCC1CCCC(NCC2CCCN2)C1
InChIInChI=1S/C12H24N2/c1-10-4-2-5-11(8-10)14-9-12-6-3-7-13-12/h10-14H,2-9H2,1H3
InChIKeyXRYHAGJRUAQOCV-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.91
Rot. Bonds3

About 3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine

3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine (PubChem CID 106636915) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
PubChem CID106636915
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
SMILESCC1CCCC(NCC2CCCN2)C1
InChIInChI=1S/C12H24N2/c1-10-4-2-5-11(8-10)14-9-12-6-3-7-13-12/h10-14H,2-9H2,1H3
InChIKeyXRYHAGJRUAQOCV-UHFFFAOYSA-N
XLogP1.91
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(azetidin-2-ylmethyl)-3-methylcyclopentan-1-amine
CID 130921273
N-(piperidin-2-ylmethyl)cyclooctanamine
CID 106632850
3-(pyrrolidin-2-ylmethylamino)cyclobutan-1-ol
CID 106638717
2-[[(3-methylcyclohexyl)amino]methyl]cyclohexan-1-ol
CID 64929988
N-methyl-1-pyrrolidin-2-ylmethanamine;molecular hydrogen
CID 153348528
5-methyl-N-(piperidin-2-ylmethyl)-2-propan-2-ylcyclohexan-1-amine
CID 106633344
cis-(1R,3S)-3-methyl-N-propylcyclohexan-1-amine
CID 15350394
4-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine
CID 106638181
trans-(1R,3R)-3-methyl-N-[(1S,3S)-3-methylcyclohexyl]cyclohexan-1-amine
CID 99646097
N,3-dimethylcyclohexan-1-amine
CID 16771259
N-(2-cyclobutylethyl)-3-methylcyclohexan-1-amine
CID 115690272
N-(2,3-dichloroprop-2-enyl)-3-methylcyclohexan-1-amine
CID 79167631

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine?
The IUPAC name of 3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine (CID 106636915) is 3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for 3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for 3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine is CC1CCCC(NCC2CCCN2)C1.
What is the InChIKey of 3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine?
The InChIKey is XRYHAGJRUAQOCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-10-4-2-5-11(8-10)14-9-12-6-3-7-13-12/h10-14H,2-9H2,1H3.
What are the key properties of 3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine?
3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine has a molecular weight of 196.34 g/mol, XLogP of 1.91, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(pyrrolidin-2-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 106636915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).