(Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine

C10H16N2 — CID 122448736

IUPAC(Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine
SMILESC=C1NCCC/C1=C/C=C(/C)N
InChIInChI=1S/C10H16N2/c1-8(11)5-6-10-4-3-7-12-9(10)2/h5-6,12H,2-4,7,11H2,1H3/b8-5-,10-6-
InChIKeyKNMDIWFTMYQSRP-UQZKWGPRSA-N
MW164.25 g/mol
LogP1.67
Rot. Bonds1

About (Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine

(Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine (PubChem CID 122448736) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is (Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine.

Molecular Properties

Compound Name(Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine
PubChem CID122448736
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name(Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine
SMILESC=C1NCCC/C1=C/C=C(/C)N
InChIInChI=1S/C10H16N2/c1-8(11)5-6-10-4-3-7-12-9(10)2/h5-6,12H,2-4,7,11H2,1H3/b8-5-,10-6-
InChIKeyKNMDIWFTMYQSRP-UQZKWGPRSA-N
XLogP1.67
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5,6-Dihydrotryptamine
CID 67559680
N-[(5Z,6E)-3-[(2Z,4E)-2-amino-1-fluorohepta-2,4-dien-4-yl]-6-(aminomethylidene)-5-prop-2-enylidenecyclohexa-1,3-dien-1-yl]piperidin-4-amine
CID 89085351
4-[4-(3-Fluoro-3-methylpyrrolidin-1-yl)penta-2,4-dien-2-yl]piperidine
CID 123309603
[6-(3-Fluoro-3-iodobutyl)-1,2-dihydropyridin-3-yl]methanamine
CID 124095642
(3E,5Z,7Z)-3-ethylidene-N-(2-fluoroethyl)-5,7-dimethyl-4-methylidenenona-1,5,7-trien-2-amine
CID 130349581
3-N-piperidin-4-yl-5-(trifluoromethyl)cyclohexa-1,5-diene-1,3-diamine
CID 134408941
(Z)-3-(2-fluoro-6-methyl-1,2-dihydropyridin-5-yl)pent-3-en-1-amine
CID 134604072
4-[(E)-2-fluoroethenyl]-3-[(Z)-prop-1-enyl]-2,8-diazaspiro[4.5]dec-3-ene
CID 143498263
(2E)-6-fluoro-2-methyl-7-piperidin-1-ylocta-2,5,7-trien-1-amine
CID 144045723
5-[(1Z)-3-(4-fluoro-4-methylpiperidin-1-yl)buta-1,3-dienyl]-4-methyl-1,2,3,6-tetrahydropyridine
CID 145128277
4-[(3Z)-5-fluorohexa-1,3,5-trien-2-yl]-N-propylcyclohexa-1,3-dien-1-amine
CID 156821650
(3E)-3-fluoro-6,10-dimethyl-7-methylidene-1,2,8,9,10,11-hexahydropyrido[4,3-b]azonine
CID 173839709

Frequently Asked Questions

What is the IUPAC name of (Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine?
The IUPAC name of (Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine (CID 122448736) is (Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine.
What is the SMILES notation for (Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine?
The canonical SMILES for (Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine is C=C1NCCC/C1=C/C=C(/C)N.
What is the InChIKey of (Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine?
The InChIKey is KNMDIWFTMYQSRP-UQZKWGPRSA-N. The full InChI is InChI=1S/C10H16N2/c1-8(11)5-6-10-4-3-7-12-9(10)2/h5-6,12H,2-4,7,11H2,1H3/b8-5-,10-6-.
What are the key properties of (Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine?
(Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine has a molecular weight of 164.25 g/mol, XLogP of 1.67, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,4Z)-4-(2-methylidenepiperidin-3-ylidene)but-2-en-2-amine is sourced from PubChem (CID 122448736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).