N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine

C16H27N3 — CID 62616448

IUPACN,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine
SMILESCNC1CCC(C)CC1CN(C)Cc1ccccn1
InChIInChI=1S/C16H27N3/c1-13-7-8-16(17-2)14(10-13)11-19(3)12-15-6-4-5-9-18-15/h4-6,9,13-14,16-17H,7-8,10-12H2,1-3H3
InChIKeyUQZHOQFNPDJSGK-UHFFFAOYSA-N
MW261.41 g/mol
LogP2.54
Rot. Bonds5

About N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine

N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine (PubChem CID 62616448) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine
PubChem CID62616448
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC NameN,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine
SMILESCNC1CCC(C)CC1CN(C)Cc1ccccn1
InChIInChI=1S/C16H27N3/c1-13-7-8-16(17-2)14(10-13)11-19(3)12-15-6-4-5-9-18-15/h4-6,9,13-14,16-17H,7-8,10-12H2,1-3H3
InChIKeyUQZHOQFNPDJSGK-UHFFFAOYSA-N
XLogP2.54
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 174963433
N-methyl-N-(pyridin-2-ylmethyl)-1-[(3R)-pyrrolidin-3-yl]methanamine
CID 94408610
N-methyl-1-(oxiran-2-yl)-N-(pyridin-2-ylmethyl)methanamine
CID 43564926
4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol
CID 115239884
ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
CID 145471467
2-[[benzyl(methyl)amino]methyl]-4-methyl-N-propylcyclohexan-1-amine
CID 63483230
1-N,2-N,2-trimethyl-1-N-(pyridin-2-ylmethyl)propane-1,2-diamine
CID 62846215
4-methyl-2-(2-pyridin-2-ylethyl)cyclohexan-1-ol
CID 79423318
N-ethyl-4-methyl-2-[[methyl(1,3-thiazol-4-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 62609438
N,4-dimethyl-2-[[methyl(pentyl)amino]methyl]cyclohexan-1-amine
CID 62615388
2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclopentan-1-one
CID 62612535
1-(methylamino)-3-[methyl(pyridin-2-ylmethyl)amino]propan-2-ol
CID 43564841

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine?
The IUPAC name of N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine (CID 62616448) is N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine.
What is the SMILES notation for N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine?
The canonical SMILES for N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine is CNC1CCC(C)CC1CN(C)Cc1ccccn1.
What is the InChIKey of N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine?
The InChIKey is UQZHOQFNPDJSGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-13-7-8-16(17-2)14(10-13)11-19(3)12-15-6-4-5-9-18-15/h4-6,9,13-14,16-17H,7-8,10-12H2,1-3H3.
What are the key properties of N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine?
N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine has a molecular weight of 261.41 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine is sourced from PubChem (CID 62616448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).