1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine

C12H23N3 — CID 134406369

IUPAC1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine
SMILESC=C(CN/C(C)=C\C)N1CCC(N)CC1
InChIInChI=1S/C12H23N3/c1-4-10(2)14-9-11(3)15-7-5-12(13)6-8-15/h4,12,14H,3,5-9,13H2,1-2H3/b10-4-
InChIKeyZDLREXFPXXWRNY-WMZJFQQLSA-N
MW209.34 g/mol
LogP1.44
Rot. Bonds4

About 1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine

1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine (PubChem CID 134406369) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is 1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine.

Molecular Properties

Compound Name1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine
PubChem CID134406369
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC Name1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine
SMILESC=C(CN/C(C)=C\C)N1CCC(N)CC1
InChIInChI=1S/C12H23N3/c1-4-10(2)14-9-11(3)15-7-5-12(13)6-8-15/h4,12,14H,3,5-9,13H2,1-2H3/b10-4-
InChIKeyZDLREXFPXXWRNY-WMZJFQQLSA-N
XLogP1.44
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine with MolForge

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Related Compounds

5-fluoro-1-(1-methylpiperidin-4-yl)-2H-pyridin-3-amine
CID 139390472
1-(3-Aminoprop-1-en-2-yl)-3-fluoropiperidin-4-amine
CID 171530774
1-[3-(Dimethylamino)prop-1-en-2-yl]-3-fluoropiperidin-4-amine
CID 171530885
1-[3-(dimethylamino)prop-1-en-2-yl]-3-fluoro-N-methylpiperidin-4-amine
CID 176992197
1-ethyl-3-fluoro-N-prop-1-en-2-ylpiperidin-4-amine
CID 178010367
N-[(E)-but-2-en-2-yl]-1-(2,2,2-trifluoroethyl)piperidin-4-amine
CID 144655062
3-(3,3-difluoropiperidin-1-yl)-N-propan-2-ylprop-1-en-2-amine
CID 170569255
1-methyl-N-(prop-2-en-1-yl)piperidin-4-amine
CID 4711811
N-methyl-N-[[(2S)-piperidin-2-yl]methyl]prop-2-en-1-amine
CID 22854132
N-methyl-N-prop-2-enylpiperidin-4-amine
CID 43607260
2-Methylidene-1-propylpiperazine
CID 53630616
1-Pent-2-en-2-yl-2-propylpiperazine
CID 54111605

Frequently Asked Questions

What is the IUPAC name of 1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine?
The IUPAC name of 1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine (CID 134406369) is 1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine.
What is the SMILES notation for 1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine?
The canonical SMILES for 1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine is C=C(CN/C(C)=C\C)N1CCC(N)CC1.
What is the InChIKey of 1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine?
The InChIKey is ZDLREXFPXXWRNY-WMZJFQQLSA-N. The full InChI is InChI=1S/C12H23N3/c1-4-10(2)14-9-11(3)15-7-5-12(13)6-8-15/h4,12,14H,3,5-9,13H2,1-2H3/b10-4-.
What are the key properties of 1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine?
1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine has a molecular weight of 209.34 g/mol, XLogP of 1.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[[(Z)-but-2-en-2-yl]amino]prop-1-en-2-yl]piperidin-4-amine is sourced from PubChem (CID 134406369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).