(1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine

C13H24N2 — CID 114620565

IUPAC(1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine
SMILESCC1CCCC(CN)N1C1C=CCCC1
InChIInChI=1S/C13H24N2/c1-11-6-5-9-13(10-14)15(11)12-7-3-2-4-8-12/h3,7,11-13H,2,4-6,8-10,14H2,1H3
InChIKeyYRWKIWSRNCMDEG-UHFFFAOYSA-N
MW208.35 g/mol
LogP2.30
Rot. Bonds2

About (1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine

(1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine (PubChem CID 114620565) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is (1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine.

Molecular Properties

Compound Name(1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine
PubChem CID114620565
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name(1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine
SMILESCC1CCCC(CN)N1C1C=CCCC1
InChIInChI=1S/C13H24N2/c1-11-6-5-9-13(10-14)15(11)12-7-3-2-4-8-12/h3,7,11-13H,2,4-6,8-10,14H2,1H3
InChIKeyYRWKIWSRNCMDEG-UHFFFAOYSA-N
XLogP2.30
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 52.30
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

(2R,6R)-2-Methyl-6-(1E)-1-propen-1-ylpiperidine
CID 5281689
2-Methyl-6-prop-1-enylpiperidine
CID 580067
1-piperidineethanamine, N-[(2E)-3,7-dimethyl-2,6-octadienyl]-2-ethyl-
CID 6482274
2-Methyl-6-(prop-2-enyl)piperidine (pinidine)
CID 5320605
1-[(Cyclohex-1-en-1-yl)methyl]piperidin-4-amine
CID 86678245
(2S)-1-N-[(4R)-4-fluorocyclohex-2-en-1-yl]-2-N-methylbutane-1,2-diamine
CID 170133644
1-(5-Fluorohept-1-en-3-yl)piperazine
CID 174315995
(3R,4R)-1-cyclohexa-2,4-dien-1-yl-4-fluoropiperidin-3-amine
CID 175959386
(2S,6S)-2-methyl-6-[(E)-prop-1-enyl]piperidine
CID 11094706
trans-2-Methyl-6-(z-4-nonenyl)piperidine
CID 129776039
beta-Coniceine hydrochloride, (E,+)-
CID 73425532
1-[(1R)-4,4-difluorocyclohex-2-en-1-yl]piperazine
CID 97050475

Frequently Asked Questions

What is the IUPAC name of (1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine?
The IUPAC name of (1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine (CID 114620565) is (1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine.
What is the SMILES notation for (1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine?
The canonical SMILES for (1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine is CC1CCCC(CN)N1C1C=CCCC1.
What is the InChIKey of (1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine?
The InChIKey is YRWKIWSRNCMDEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2/c1-11-6-5-9-13(10-14)15(11)12-7-3-2-4-8-12/h3,7,11-13H,2,4-6,8-10,14H2,1H3.
What are the key properties of (1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine?
(1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine has a molecular weight of 208.35 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclohex-2-en-1-yl-6-methylpiperidin-2-yl)methanamine is sourced from PubChem (CID 114620565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).