ethane;1-methylpiperidin-4-amine

C8H20N2 — CID 123622295

IUPACethane;1-methylpiperidin-4-amine
SMILESCC.CN1CCC(N)CC1
InChIInChI=1S/C6H14N2.C2H6/c1-8-4-2-6(7)3-5-8;1-2/h6H,2-5,7H2,1H3;1-2H3
InChIKeyLDXJLMFJTJPUHR-UHFFFAOYSA-N
MW144.26 g/mol
LogP1.07
Rot. Bonds

About ethane;1-methylpiperidin-4-amine

ethane;1-methylpiperidin-4-amine (PubChem CID 123622295) has the molecular formula C8H20N2 and a molecular weight of 144.26 g/mol. Its IUPAC name is ethane;1-methylpiperidin-4-amine.

Molecular Properties

Compound Nameethane;1-methylpiperidin-4-amine
PubChem CID123622295
Molecular FormulaC8H20N2
Molecular Weight144.26 g/mol
Exact Mass144.16
IUPAC Nameethane;1-methylpiperidin-4-amine
SMILESCC.CN1CCC(N)CC1
InChIInChI=1S/C6H14N2.C2H6/c1-8-4-2-6(7)3-5-8;1-2/h6H,2-5,7H2,1H3;1-2H3
InChIKeyLDXJLMFJTJPUHR-UHFFFAOYSA-N
XLogP1.07
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.26
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4R)-1-methylazocan-4-amine
CID 166102588
cyclobutanamine;1-methylpyrrolidine
CID 167503696
1-N-(1-methylpiperidin-4-yl)piperidine-1,4-diamine
CID 145481101
1-(1-methylazepan-4-yl)piperidin-4-amine
CID 65074908
ethane;(1-methylpiperidin-4-yl)methanamine
CID 91043349
1-methylpyrrolidin-3-amine;sulfanol
CID 143564913
di(piperidin-1-yl)methanone;1-methylpiperidin-4-amine
CID 174339916
1-N-(1-methylpiperidin-4-yl)cyclobutane-1,3-diamine
CID 80559526
1,4-dimethylpiperidin-3-amine;ethane
CID 169133952
ethane;fluoromethane;3-fluoro-1-methylpyrrolidine
CID 177157428
(4R)-1-methylpiperidine-3,4-diamine
CID 145189555
1-[1-(1-methylazepan-4-yl)pyrrolidin-3-yl]piperidin-4-amine
CID 80552910

Frequently Asked Questions

What is the IUPAC name of ethane;1-methylpiperidin-4-amine?
The IUPAC name of ethane;1-methylpiperidin-4-amine (CID 123622295) is ethane;1-methylpiperidin-4-amine.
What is the SMILES notation for ethane;1-methylpiperidin-4-amine?
The canonical SMILES for ethane;1-methylpiperidin-4-amine is CC.CN1CCC(N)CC1.
What is the InChIKey of ethane;1-methylpiperidin-4-amine?
The InChIKey is LDXJLMFJTJPUHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2.C2H6/c1-8-4-2-6(7)3-5-8;1-2/h6H,2-5,7H2,1H3;1-2H3.
What are the key properties of ethane;1-methylpiperidin-4-amine?
ethane;1-methylpiperidin-4-amine has a molecular weight of 144.26 g/mol, XLogP of 1.07, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-methylpiperidin-4-amine is sourced from PubChem (CID 123622295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).