N,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride

C14H21ClN2 — CID 69220584

IUPACN,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride
SMILESCN(C)CC1CCCC=C1c1cccnc1.Cl
InChIInChI=1S/C14H20N2.ClH/c1-16(2)11-13-6-3-4-8-14(13)12-7-5-9-15-10-12;/h5,7-10,13H,3-4,6,11H2,1-2H3;1H
InChIKeyNUWYBCUYQLHHFR-UHFFFAOYSA-N
MW252.79 g/mol
LogP3.25
Rot. Bonds3

About N,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride

N,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride (PubChem CID 69220584) has the molecular formula C14H21ClN2 and a molecular weight of 252.79 g/mol. Its IUPAC name is N,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride.

Molecular Properties

Compound NameN,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride
PubChem CID69220584
Molecular FormulaC14H21ClN2
Molecular Weight252.79 g/mol
Exact Mass252.14
IUPAC NameN,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride
SMILESCN(C)CC1CCCC=C1c1cccnc1.Cl
InChIInChI=1S/C14H20N2.ClH/c1-16(2)11-13-6-3-4-8-14(13)12-7-5-9-15-10-12;/h5,7-10,13H,3-4,6,11H2,1-2H3;1H
InChIKeyNUWYBCUYQLHHFR-UHFFFAOYSA-N
XLogP3.25
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.79
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-propyl-N-[(2-pyridin-3-ylcyclohex-2-en-1-yl)methyl]propan-1-amine;hydrochloride
CID 69223024
N,N-dimethyl-1-(2-pyridin-3-ylphenyl)methanamine
CID 90921130
5-N-(cyclohexylmethyl)-5-N-methyl-4-pyridin-3-yl-1,2-thiazole-3,5-diamine
CID 103361808
3-pyridin-3-yl-6,7,8,8a-tetrahydro-5H-[1,2]oxazolo[5,4-b]azepine
CID 45076580
N,N-dimethyl-1-(2,3,4,5-tetrahydro-1H-1-benzazepin-5-yl)methanamine;hydrochloride
CID 165145885
bis(2-methylpropane);3-pyridin-3-ylpyridine
CID 158581875
4-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 54928175
N-methyl-1-[(3R)-oxolan-3-yl]-N-[(3-pyridin-3-ylphenyl)methyl]methanamine
CID 97160402
N,N-dimethyl-1-(4-pyridin-3-yl-3,6-dihydro-2H-pyran-5-yl)methanamine;hydrochloride
CID 69221757
cyclopenta[c]azepine
CID 638010
N,N-dimethyl-2-(5-pyridin-3-yl-2,3-dihydro-1H-indol-3-yl)ethanamine
CID 169244304
N'-cyclopentyl-N'-methyl-N-[(5-pyridin-3-yl-1H-pyrazol-4-yl)methyl]ethane-1,2-diamine
CID 119123770

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride?
The IUPAC name of N,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride (CID 69220584) is N,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride.
What is the SMILES notation for N,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride?
The canonical SMILES for N,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride is CN(C)CC1CCCC=C1c1cccnc1.Cl.
What is the InChIKey of N,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride?
The InChIKey is NUWYBCUYQLHHFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2.ClH/c1-16(2)11-13-6-3-4-8-14(13)12-7-5-9-15-10-12;/h5,7-10,13H,3-4,6,11H2,1-2H3;1H.
What are the key properties of N,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride?
N,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride has a molecular weight of 252.79 g/mol, XLogP of 3.25, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(2-pyridin-3-ylcyclohex-2-en-1-yl)methanamine;hydrochloride is sourced from PubChem (CID 69220584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).