N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine

C15H31N3 — CID 115244956

IUPACN-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine
SMILESCNCC1(CN(C)CCC2CCCN(C)C2)CC1
InChIInChI=1S/C15H31N3/c1-16-12-15(7-8-15)13-18(3)10-6-14-5-4-9-17(2)11-14/h14,16H,4-13H2,1-3H3
InChIKeyRDKRXNBOEAGUCD-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.65
Rot. Bonds7

About N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine

N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine (PubChem CID 115244956) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine
PubChem CID115244956
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC NameN-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine
SMILESCNCC1(CN(C)CCC2CCCN(C)C2)CC1
InChIInChI=1S/C15H31N3/c1-16-12-15(7-8-15)13-18(3)10-6-14-5-4-9-17(2)11-14/h14,16H,4-13H2,1-3H3
InChIKeyRDKRXNBOEAGUCD-UHFFFAOYSA-N
XLogP1.65
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclohexyl-N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]ethanamine
CID 115246324
[methyl-[2-(1-methylpiperidin-3-yl)ethyl]amino]methanol
CID 115229573
N-[[1-(aminomethyl)cyclopropyl]methyl]-N-methyl-1-(1-methylpiperidin-3-yl)methanamine
CID 115244261
1-N,2-dimethyl-1-N-[2-(1-methylpiperidin-3-yl)ethyl]propane-1,2-diamine
CID 115136320
[1-[[methyl-[(1-methylpiperidin-3-yl)methyl]amino]methyl]cyclobutyl]methanol
CID 115247057
ethane;methane;N-methyl-N-[(3-methylcyclopent-3-en-1-yl)methyl]-2-(1-methylpiperidin-3-yl)ethanamine
CID 142067707
2-(methylamino)-3-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]amino]propanoic acid
CID 115256304
N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine
CID 117044255
N-methyl-1-(methylaminomethyl)-N-[2-(1-methylpyrrolidin-3-yl)ethyl]cyclopropane-1-carboxamide
CID 115183166
N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine
CID 115209441
N-methyl-N'-[2-(1-methylpiperidin-3-yl)ethyl]ethane-1,2-diamine
CID 115196067
1-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]pyrrolidin-3-amine
CID 115244573

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine?
The IUPAC name of N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine (CID 115244956) is N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine.
What is the SMILES notation for N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine?
The canonical SMILES for N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine is CNCC1(CN(C)CCC2CCCN(C)C2)CC1.
What is the InChIKey of N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine?
The InChIKey is RDKRXNBOEAGUCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-16-12-15(7-8-15)13-18(3)10-6-14-5-4-9-17(2)11-14/h14,16H,4-13H2,1-3H3.
What are the key properties of N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine?
N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine has a molecular weight of 253.43 g/mol, XLogP of 1.65, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[1-(methylaminomethyl)cyclopropyl]methyl]-2-(1-methylpiperidin-3-yl)ethanamine is sourced from PubChem (CID 115244956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).