N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine

C14H26N2 — CID 107908235

IUPACN-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine
SMILESCN1CCC(CCNC2C=CCCC2)CC1
InChIInChI=1S/C14H26N2/c1-16-11-8-13(9-12-16)7-10-15-14-5-3-2-4-6-14/h3,5,13-15H,2,4,6-12H2,1H3
InChIKeyGKBWVDRBTNULPS-UHFFFAOYSA-N
MW222.38 g/mol
LogP2.42
Rot. Bonds4

About N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine

N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine (PubChem CID 107908235) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine.

Molecular Properties

Compound NameN-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine
PubChem CID107908235
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC NameN-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine
SMILESCN1CCC(CCNC2C=CCCC2)CC1
InChIInChI=1S/C14H26N2/c1-16-11-8-13(9-12-16)7-10-15-14-5-3-2-4-6-14/h3,5,13-15H,2,4,6-12H2,1H3
InChIKeyGKBWVDRBTNULPS-UHFFFAOYSA-N
XLogP2.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-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

N-[2-(3-methylcyclohexyl)ethyl]cyclohex-2-en-1-amine
CID 107907027
N-(2-cyclobutylethyl)-1-methylpiperidin-4-amine
CID 115893453
N-[2-(1-methylpiperidin-4-yl)ethyl]cyclooctanamine
CID 115717422
4-ethyl-N-[2-(1-methylpiperidin-4-yl)ethyl]cycloheptan-1-amine
CID 114515181
N-[3-(2-methylpiperidin-1-yl)propyl]cyclohex-2-en-1-amine
CID 107906360
N-[2-(1-methylpiperidin-4-yl)ethyl]-3-propan-2-ylcyclohexan-1-amine
CID 107448828
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-(trifluoromethyl)cyclohexan-1-amine
CID 114515257
[2-(1-methylpiperidin-4-yl)ethylamino]methanol
CID 115229407
3-methyl-N-[2-(1-methylpiperidin-4-yl)ethyl]cyclobutan-1-amine
CID 104859771
N-(3-methylbut-2-enyl)cyclohex-2-en-1-amine
CID 106547294
N-(5-methylhexyl)cyclohex-2-en-1-amine
CID 107907594
5-(cyclohex-2-en-1-ylamino)pentan-2-ol
CID 106131433

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine?
The IUPAC name of N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine (CID 107908235) is N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine.
What is the SMILES notation for N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine?
The canonical SMILES for N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine is CN1CCC(CCNC2C=CCCC2)CC1.
What is the InChIKey of N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine?
The InChIKey is GKBWVDRBTNULPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-16-11-8-13(9-12-16)7-10-15-14-5-3-2-4-6-14/h3,5,13-15H,2,4,6-12H2,1H3.
What are the key properties of N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine?
N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine has a molecular weight of 222.38 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylpiperidin-4-yl)ethyl]cyclohex-2-en-1-amine is sourced from PubChem (CID 107908235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).