N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane

C17H42N4 — CID 160736094

IUPACN,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane
SMILESC.CC1CCN(C)CC1.CN(C)C.CN1CCN(C)CC1
InChIInChI=1S/C7H15N.C6H14N2.C3H9N.CH4/c2*1-7-3-5-8(2)6-4-7;1-4(2)3;/h7H,3-6H2,1-2H3;3-6H2,1-2H3;1-3H3;1H4
InChIKeyRUYUMFIWQOKOHH-UHFFFAOYSA-N
MW302.55 g/mol
LogP2.03
Rot. Bonds

About N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane

N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane (PubChem CID 160736094) has the molecular formula C17H42N4 and a molecular weight of 302.55 g/mol. Its IUPAC name is N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane.

Molecular Properties

Compound NameN,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane
PubChem CID160736094
Molecular FormulaC17H42N4
Molecular Weight302.55 g/mol
Exact Mass302.34
IUPAC NameN,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane
SMILESC.CC1CCN(C)CC1.CN(C)C.CN1CCN(C)CC1
InChIInChI=1S/C7H15N.C6H14N2.C3H9N.CH4/c2*1-7-3-5-8(2)6-4-7;1-4(2)3;/h7H,3-6H2,1-2H3;3-6H2,1-2H3;1-3H3;1H4
InChIKeyRUYUMFIWQOKOHH-UHFFFAOYSA-N
XLogP2.03
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.55
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Piperidinium, 1,1',1'-trimethyl-1,4'-ethylenedi-, diiodide
CID 3048569
1-(2-Methyl-4-piperidin-1-ylbutyl)piperidine
CID 11128366
Piperidine, 1,1'-(1,2-ethanediyl)bis[3-methyl-
CID 107031
1-Ethyl-4-[2-(1-fluoropiperidin-4-yl)ethyl]piperazine
CID 145302364
1-Tert-butyl-4-[[4-fluoro-1-(2-methylpropyl)piperidin-4-yl]methyl]piperazine
CID 153484479
2-(1-Fluoropropyl)-1-(2-methylpropyl)-4-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]piperazine
CID 154669985
4-[2-(1-Ethylpiperidin-4-yl)ethyl]-2-(1-fluoropropyl)-1-(2-methylpropyl)piperazine
CID 154670214
1-[2-(1-Ethyl-2,2-difluoropiperidin-4-yl)ethyl]-4-propylpiperazine
CID 154670515
1-[2-(3,3-Difluoro-1-methylpiperidin-4-yl)ethyl]-4-(2-methylpropyl)piperazine
CID 154671789
1-[(4-Fluoro-1-propan-2-ylpiperidin-4-yl)methyl]-4-propan-2-ylpiperazine
CID 167417673
1-[(1-Ethyl-4-fluoropiperidin-4-yl)methyl]-4-methylpiperazine
CID 168081162
1-[(3-Fluoro-1-methylpiperidin-4-yl)methyl]-4-methylpiperazine
CID 169862596

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane?
The IUPAC name of N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane (CID 160736094) is N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane.
What is the SMILES notation for N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane?
The canonical SMILES for N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane is C.CC1CCN(C)CC1.CN(C)C.CN1CCN(C)CC1.
What is the InChIKey of N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane?
The InChIKey is RUYUMFIWQOKOHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N.C6H14N2.C3H9N.CH4/c2*1-7-3-5-8(2)6-4-7;1-4(2)3;/h7H,3-6H2,1-2H3;3-6H2,1-2H3;1-3H3;1H4.
What are the key properties of N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane?
N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane has a molecular weight of 302.55 g/mol, XLogP of 2.03, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylmethanamine;1,4-dimethylpiperazine;1,4-dimethylpiperidine;methane is sourced from PubChem (CID 160736094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).