N-cyclohexyl-N,4-dimethylpyrrolidin-3-amine

C12H24N2 — CID 81460081

IUPACN-cyclohexyl-N,4-dimethylpyrrolidin-3-amine
SMILESCC1CNCC1N(C)C1CCCCC1
InChIInChI=1S/C12H24N2/c1-10-8-13-9-12(10)14(2)11-6-4-3-5-7-11/h10-13H,3-9H2,1-2H3
InChIKeyMDWHCOHSBWSQTQ-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.86
Rot. Bonds2

About N-cyclohexyl-N,4-dimethylpyrrolidin-3-amine

N-cyclohexyl-N,4-dimethylpyrrolidin-3-amine (PubChem CID 81460081) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N-cyclohexyl-N,4-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-cyclohexyl-N,4-dimethylpyrrolidin-3-amine
PubChem CID81460081
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN-cyclohexyl-N,4-dimethylpyrrolidin-3-amine
SMILESCC1CNCC1N(C)C1CCCCC1
InChIInChI=1S/C12H24N2/c1-10-8-13-9-12(10)14(2)11-6-4-3-5-7-11/h10-13H,3-9H2,1-2H3
InChIKeyMDWHCOHSBWSQTQ-UHFFFAOYSA-N
XLogP1.86
TPSA15.27 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 ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N,4-dimethylpyrrolidin-3-amine?
The IUPAC name of N-cyclohexyl-N,4-dimethylpyrrolidin-3-amine (CID 81460081) is N-cyclohexyl-N,4-dimethylpyrrolidin-3-amine.
What is the SMILES notation for N-cyclohexyl-N,4-dimethylpyrrolidin-3-amine?
The canonical SMILES for N-cyclohexyl-N,4-dimethylpyrrolidin-3-amine is CC1CNCC1N(C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N,4-dimethylpyrrolidin-3-amine?
The InChIKey is MDWHCOHSBWSQTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-10-8-13-9-12(10)14(2)11-6-4-3-5-7-11/h10-13H,3-9H2,1-2H3.
What are the key properties of N-cyclohexyl-N,4-dimethylpyrrolidin-3-amine?
N-cyclohexyl-N,4-dimethylpyrrolidin-3-amine has a molecular weight of 196.34 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N,4-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 81460081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).