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

C13H26N2 — CID 106191056

IUPACN-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine
SMILESCCNC1CCN(CC=C(C)C)C(C)C1
InChIInChI=1S/C13H26N2/c1-5-14-13-7-9-15(12(4)10-13)8-6-11(2)3/h6,12-14H,5,7-10H2,1-4H3
InChIKeyPQOJAOUYBPPGBW-UHFFFAOYSA-N
MW210.37 g/mol
LogP2.41
Rot. Bonds4

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

N-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine (PubChem CID 106191056) has the molecular formula C13H26N2 and a molecular weight of 210.37 g/mol. Its IUPAC name is N-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine
PubChem CID106191056
Molecular FormulaC13H26N2
Molecular Weight210.37 g/mol
Exact Mass210.21
IUPAC NameN-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine
SMILESCCNC1CCN(CC=C(C)C)C(C)C1
InChIInChI=1S/C13H26N2/c1-5-14-13-7-9-15(12(4)10-13)8-6-11(2)3/h6,12-14H,5,7-10H2,1-4H3
InChIKeyPQOJAOUYBPPGBW-UHFFFAOYSA-N
XLogP2.41
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.37
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4-dimethyl-1-(3-methylbut-2-enyl)piperidine
CID 130634349
N-ethyl-1-(3-methylbut-2-enyl)piperidin-4-amine
CID 43755150
N-ethyl-1-(3-methylbut-2-enyl)pyrrolidin-3-amine
CID 106191040
1-[(1,4-dimethylpiperidin-4-yl)methyl]-N-ethyl-2-methylpiperidin-4-amine
CID 107164166
N-(2-bromoprop-2-enyl)-1-ethyl-2-methylpiperidin-4-amine
CID 115717320
1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-ethyl-2-methylpiperidin-4-amine
CID 79242411
1-(1,4-dithian-2-ylmethyl)-N-ethyl-2-methylpiperidin-4-amine
CID 113489426
(2S)-1-[(1-ethyl-2-methylpiperidin-4-yl)amino]propan-2-ol
CID 103906419
N-ethyl-2-methyl-1-(thiophen-3-ylmethyl)piperidin-4-amine
CID 63248087
2,4-dimethyl-1-(3-methylbut-2-enyl)pyrrolidine
CID 126995395
N-ethyl-2-methyl-1-(3-methylpentan-3-yl)piperidin-4-amine
CID 106329207
N-ethyl-2-methyl-1-[(5-methyl-1,3-thiazol-2-yl)methyl]piperidin-4-amine
CID 114127659

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine?
The IUPAC name of N-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine (CID 106191056) is N-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine.
What is the SMILES notation for N-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine?
The canonical SMILES for N-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine is CCNC1CCN(CC=C(C)C)C(C)C1.
What is the InChIKey of N-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine?
The InChIKey is PQOJAOUYBPPGBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-5-14-13-7-9-15(12(4)10-13)8-6-11(2)3/h6,12-14H,5,7-10H2,1-4H3.
What are the key properties of N-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine?
N-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine has a molecular weight of 210.37 g/mol, XLogP of 2.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methyl-1-(3-methylbut-2-enyl)piperidin-4-amine is sourced from PubChem (CID 106191056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).