N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine

C12H26N2 — CID 117044255

IUPACN-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine
SMILESCC(C)N(C)CCC1CCCN(C)C1
InChIInChI=1S/C12H26N2/c1-11(2)14(4)9-7-12-6-5-8-13(3)10-12/h11-12H,5-10H2,1-4H3
InChIKeyFOSPNCTUJQEPMG-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.06
Rot. Bonds4

About N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine

N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine (PubChem CID 117044255) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine
PubChem CID117044255
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC NameN-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine
SMILESCC(C)N(C)CCC1CCCN(C)C1
InChIInChI=1S/C12H26N2/c1-11(2)14(4)9-7-12-6-5-8-13(3)10-12/h11-12H,5-10H2,1-4H3
InChIKeyFOSPNCTUJQEPMG-UHFFFAOYSA-N
XLogP2.06
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyclobutylethyl)-N-methylpropan-2-amine
CID 117044257
[methyl-[2-(1-methylpiperidin-3-yl)ethyl]amino]methanol
CID 115229573
1-methyl-3-(2-propan-2-yloxyethyl)piperidine
CID 169034936
1-N,2-dimethyl-1-N-[2-(1-methylpiperidin-3-yl)ethyl]propane-1,2-diamine
CID 115136320
3-methyl-3-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]amino]butan-1-ol
CID 115134356
3-cyclopentyl-N-methyl-N-propan-2-ylpropan-1-amine
CID 21034246
N,N-dimethyl-1-(1-methylpiperidin-3-yl)methanamine;propane
CID 142888421
N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine
CID 115209441
N-[[(3R)-1-(2-aminoethyl)piperidin-3-yl]methyl]-N-methylpropan-2-amine
CID 96554802
1-N,1-N-dimethyl-3-N-[(1-methylpiperidin-3-yl)methyl]butane-1,3-diamine
CID 62658319
2-(methylamino)-3-[methyl-[2-(1-methylpiperidin-3-yl)ethyl]amino]propanoic acid
CID 115256304
(3S)-3-(methoxymethyl)-1-methylpiperidine
CID 58134332

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine?
The IUPAC name of N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine (CID 117044255) is N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine.
What is the SMILES notation for N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine?
The canonical SMILES for N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine is CC(C)N(C)CCC1CCCN(C)C1.
What is the InChIKey of N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine?
The InChIKey is FOSPNCTUJQEPMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-11(2)14(4)9-7-12-6-5-8-13(3)10-12/h11-12H,5-10H2,1-4H3.
What are the key properties of N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine?
N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine has a molecular weight of 198.35 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine is sourced from PubChem (CID 117044255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).