N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine

C12H24N2 — CID 43755150

IUPACN-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine
SMILESCCNC1CCN(CC=C(C)C)CC1
InChIInChI=1S/C12H24N2/c1-4-13-12-6-9-14(10-7-12)8-5-11(2)3/h5,12-13H,4,6-10H2,1-3H3
InChIKeyYPABMCXBGISCIT-UHFFFAOYSA-N
MW196.34 g/mol
LogP2.03
Rot. Bonds4

About N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine

N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine (PubChem CID 43755150) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine
PubChem CID43755150
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine
SMILESCCNC1CCN(CC=C(C)C)CC1
InChIInChI=1S/C12H24N2/c1-4-13-12-6-9-14(10-7-12)8-5-11(2)3/h5,12-13H,4,6-10H2,1-3H3
InChIKeyYPABMCXBGISCIT-UHFFFAOYSA-N
XLogP2.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-1-(3-methylbut-2-enyl)pyrrolidin-3-amine
CID 106191040
1-(3-methylbut-2-enyl)-N-prop-2-enylpiperidin-4-amine
CID 43755403
1-(3-methylbut-2-enyl)-N-octylpiperidin-4-amine
CID 115566614
N-cyclobutyl-1-(3-methylbut-2-enyl)piperidin-4-amine
CID 62415331
N-ethoxy-1-(3-methylbut-2-enyl)piperidin-4-amine
CID 82710058
4-[[1-(3-methylbut-2-enyl)piperidin-4-yl]amino]butan-2-ol
CID 64911106
6-[[1-(3-methylbut-2-enyl)piperidin-4-yl]amino]hexan-1-ol
CID 103922270
3-[[1-(3-methylbut-2-enyl)piperidin-4-yl]amino]propane-1,2-diol
CID 66177156
N-[[1-(3-methylbut-2-enyl)piperidin-4-yl]methyl]ethanamine
CID 63848559
N'-cyclopropyl-N'-ethyl-N-[1-(3-methylbut-2-enyl)piperidin-4-yl]ethane-1,2-diamine
CID 103780437
3-[[[1-(3-methylbut-2-enyl)piperidin-4-yl]amino]methyl]cyclopentan-1-ol
CID 103271380
1-(3-methylbut-2-enyl)-N-[(1-methylcyclobutyl)methyl]piperidin-4-amine
CID 103903178

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine?
The IUPAC name of N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine (CID 43755150) is N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine.
What is the SMILES notation for N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine?
The canonical SMILES for N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine is CCNC1CCN(CC=C(C)C)CC1.
What is the InChIKey of N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine?
The InChIKey is YPABMCXBGISCIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-4-13-12-6-9-14(10-7-12)8-5-11(2)3/h5,12-13H,4,6-10H2,1-3H3.
What are the key properties of N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine?
N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine has a molecular weight of 196.34 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine is sourced from PubChem (CID 43755150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).