N,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane

C13H28N2 — CID 171531220

IUPACN,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane
SMILESC=C(CN(C)C)N1CCCCC1C.CC
InChIInChI=1S/C11H22N2.C2H6/c1-10-7-5-6-8-13(10)11(2)9-12(3)4;1-2/h10H,2,5-9H2,1,3-4H3;1-2H3
InChIKeyTTYDGJFEGHTIIN-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.96
Rot. Bonds3

About N,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane

N,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane (PubChem CID 171531220) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane.

Molecular Properties

Compound NameN,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane
PubChem CID171531220
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane
SMILESC=C(CN(C)C)N1CCCCC1C.CC
InChIInChI=1S/C11H22N2.C2H6/c1-10-7-5-6-8-13(10)11(2)9-12(3)4;1-2/h10H,2,5-9H2,1,3-4H3;1-2H3
InChIKeyTTYDGJFEGHTIIN-UHFFFAOYSA-N
XLogP2.96
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-methylidene-1-propan-2-yl-2H-pyrrol-3-yl)piperidine
CID 58336937
1-Propan-2-yl-4-prop-1-en-2-ylpiperazine
CID 58547477
1-Methyl-2-methylidene-4-propan-2-ylpiperazine
CID 58548422
1-Ethyl-4-methyl-2-methylidenepiperazine
CID 58871661
1-(1-Propan-2-ylpiperidin-3-yl)-4-prop-1-en-2-ylpiperazine
CID 58932404
N,N-dimethyl-2-(4-methylidenepiperidin-1-yl)prop-2-en-1-amine
CID 58970804
1-Ethyl-3-methylidenepiperazin-4-ide;pentane;yttrium
CID 59044874
Carbanide;3-methylidene-1-propylpiperazin-4-ide;yttrium
CID 60094058
(2S)-1,2,3,4-tetramethyl-5,6-dimethylidenepiperazine
CID 60095837
2-Pentyl-1,4-bis(prop-2-enyl)piperazine
CID 67045067
1-(2-Pyrrolidin-1-ylprop-2-enyl)piperidine
CID 67615401
2-Methylidene-1,4-di(propan-2-yl)piperazine
CID 68267223

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane?
The IUPAC name of N,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane (CID 171531220) is N,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane.
What is the SMILES notation for N,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane?
The canonical SMILES for N,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane is C=C(CN(C)C)N1CCCCC1C.CC.
What is the InChIKey of N,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane?
The InChIKey is TTYDGJFEGHTIIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2.C2H6/c1-10-7-5-6-8-13(10)11(2)9-12(3)4;1-2/h10H,2,5-9H2,1,3-4H3;1-2H3.
What are the key properties of N,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane?
N,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane has a molecular weight of 212.38 g/mol, XLogP of 2.96, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(2-methylpiperidin-1-yl)prop-2-en-1-amine;ethane is sourced from PubChem (CID 171531220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).