1-(1-methylpiperidin-3-yl)ethenamine

C8H16N2 — CID 58035148

IUPAC1-(1-methylpiperidin-3-yl)ethenamine
SMILESC=C(N)C1CCCN(C)C1
InChIInChI=1S/C8H16N2/c1-7(9)8-4-3-5-10(2)6-8/h8H,1,3-6,9H2,2H3
InChIKeyKIINVLIRAVCJNJ-UHFFFAOYSA-N
MW140.23 g/mol
LogP0.80
Rot. Bonds1

About 1-(1-methylpiperidin-3-yl)ethenamine

1-(1-methylpiperidin-3-yl)ethenamine (PubChem CID 58035148) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 1-(1-methylpiperidin-3-yl)ethenamine.

Molecular Properties

Compound Name1-(1-methylpiperidin-3-yl)ethenamine
PubChem CID58035148
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name1-(1-methylpiperidin-3-yl)ethenamine
SMILESC=C(N)C1CCCN(C)C1
InChIInChI=1S/C8H16N2/c1-7(9)8-4-3-5-10(2)6-8/h8H,1,3-6,9H2,2H3
InChIKeyKIINVLIRAVCJNJ-UHFFFAOYSA-N
XLogP0.80
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methylpiperidine-3-carboximidamide
CID 42614742
2-(1-methylpiperidin-3-yl)prop-2-enal
CID 117266772
N-methyl-2-(1-methylpiperidin-3-yl)prop-2-en-1-amine
CID 117266322
1-methylpiperidine-3-carbothioic S-acid
CID 116918903
(3S)-1-methylpiperidine-3-carboxylic acid;hydrochloride
CID 67923100
1-methylpiperidine-3-carboxylic acid;hydrochloride
CID 12514711
ethane;(1E,3Z)-N'-ethenyl-1-(1-methylpiperidin-3-yl)buta-1,3-diene-1,4-diamine
CID 142523610
ethyl (3R)-1-methylpiperidine-3-carboxylate
CID 736036
(4-aminopiperidin-1-yl)-[(3R)-1-methylpiperidin-3-yl]methanone
CID 129493268
1-[(3R)-1-methylpiperidin-3-yl]propan-1-one
CID 96635007
2,2-dimethyl-1-[(3R)-1-methylpiperidin-3-yl]propan-1-one
CID 155222976
3-amino-3-methyl-1-(1-methylpiperidin-3-yl)butan-1-one
CID 116915795

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpiperidin-3-yl)ethenamine?
The IUPAC name of 1-(1-methylpiperidin-3-yl)ethenamine (CID 58035148) is 1-(1-methylpiperidin-3-yl)ethenamine.
What is the SMILES notation for 1-(1-methylpiperidin-3-yl)ethenamine?
The canonical SMILES for 1-(1-methylpiperidin-3-yl)ethenamine is C=C(N)C1CCCN(C)C1.
What is the InChIKey of 1-(1-methylpiperidin-3-yl)ethenamine?
The InChIKey is KIINVLIRAVCJNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-7(9)8-4-3-5-10(2)6-8/h8H,1,3-6,9H2,2H3.
What are the key properties of 1-(1-methylpiperidin-3-yl)ethenamine?
1-(1-methylpiperidin-3-yl)ethenamine has a molecular weight of 140.23 g/mol, XLogP of 0.80, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylpiperidin-3-yl)ethenamine is sourced from PubChem (CID 58035148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).