1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine

C11H22N2 — CID 144864042

IUPAC1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine
SMILESC/C=C(\C)N1CCC(N(C)C)CC1
InChIInChI=1S/C11H22N2/c1-5-10(2)13-8-6-11(7-9-13)12(3)4/h5,11H,6-9H2,1-4H3/b10-5+
InChIKeyXWZLTSCHRJDJPR-BJMVGYQFSA-N
MW182.31 g/mol
LogP1.94
Rot. Bonds2

About 1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine

1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine (PubChem CID 144864042) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine
PubChem CID144864042
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine
SMILESC/C=C(\C)N1CCC(N(C)C)CC1
InChIInChI=1S/C11H22N2/c1-5-10(2)13-8-6-11(7-9-13)12(3)4/h5,11H,6-9H2,1-4H3/b10-5+
InChIKeyXWZLTSCHRJDJPR-BJMVGYQFSA-N
XLogP1.94
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(C,N-dimethylcarbonimidoyl)-N,N-dimethylpiperidin-4-amine
CID 143990258
1-[4-(dimethylamino)piperidin-1-yl]ethanone;propane
CID 143677842
(1E,3Z)-1-[4-(dimethylamino)piperidin-1-yl]penta-1,3-diene-1,4-diamine
CID 134406903
4-(dimethylamino)-N,N-dimethylpiperidine-1-carboxamide
CID 110470375
2-[4-(dimethylamino)piperidin-1-yl]-2-oxoacetic acid
CID 43586380
4-(dimethylamino)piperidine-1-carbonyl chloride;hydrochloride
CID 155821051
cyclopropyl-[4-(dimethylamino)piperidin-1-yl]methanone
CID 60763903
tris(1-[4-(dimethylamino)piperidin-1-yl]butane-1,3-dione);iron(3+)
CID 53467781
4-(dimethylamino)-N-methylpiperidine-1-carbothioamide
CID 115583416
N'-amino-4-(dimethylamino)piperidine-1-carboximidamide
CID 77053935
1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone
CID 144771309
2-chloro-1-[4-(dimethylamino)piperidin-1-yl]propan-1-one
CID 43585925

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine?
The IUPAC name of 1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine (CID 144864042) is 1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine?
The canonical SMILES for 1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine is C/C=C(\C)N1CCC(N(C)C)CC1.
What is the InChIKey of 1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine?
The InChIKey is XWZLTSCHRJDJPR-BJMVGYQFSA-N. The full InChI is InChI=1S/C11H22N2/c1-5-10(2)13-8-6-11(7-9-13)12(3)4/h5,11H,6-9H2,1-4H3/b10-5+.
What are the key properties of 1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine?
1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine has a molecular weight of 182.31 g/mol, XLogP of 1.94, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-but-2-en-2-yl]-N,N-dimethylpiperidin-4-amine is sourced from PubChem (CID 144864042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).