N-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine

C19H38N2 — CID 63464938

IUPACN-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine
SMILESCNC1CCCCCCCCCCC1N1CCCCC1C
InChIInChI=1S/C19H38N2/c1-17-13-11-12-16-21(17)19-15-10-8-6-4-3-5-7-9-14-18(19)20-2/h17-20H,3-16H2,1-2H3
InChIKeyKZWQTZOMVFEZNE-UHFFFAOYSA-N
MW294.53 g/mol
LogP4.73
Rot. Bonds2

About N-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine

N-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine (PubChem CID 63464938) has the molecular formula C19H38N2 and a molecular weight of 294.53 g/mol. Its IUPAC name is N-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine.

Molecular Properties

Compound NameN-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine
PubChem CID63464938
Molecular FormulaC19H38N2
Molecular Weight294.53 g/mol
Exact Mass294.30
IUPAC NameN-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine
SMILESCNC1CCCCCCCCCCC1N1CCCCC1C
InChIInChI=1S/C19H38N2/c1-17-13-11-12-16-21(17)19-15-10-8-6-4-3-5-7-9-14-18(19)20-2/h17-20H,3-16H2,1-2H3
InChIKeyKZWQTZOMVFEZNE-UHFFFAOYSA-N
XLogP4.73
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.53
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine?
The IUPAC name of N-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine (CID 63464938) is N-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine.
What is the SMILES notation for N-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine?
The canonical SMILES for N-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine is CNC1CCCCCCCCCCC1N1CCCCC1C.
What is the InChIKey of N-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine?
The InChIKey is KZWQTZOMVFEZNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N2/c1-17-13-11-12-16-21(17)19-15-10-8-6-4-3-5-7-9-14-18(19)20-2/h17-20H,3-16H2,1-2H3.
What are the key properties of N-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine?
N-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine has a molecular weight of 294.53 g/mol, XLogP of 4.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-methylpiperidin-1-yl)cyclododecan-1-amine is sourced from PubChem (CID 63464938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).