N-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine

C17H29N3 — CID 65241177

IUPACN-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine
SMILESCNC1(CCN(C)CCc2ccccn2)CCCCC1
InChIInChI=1S/C17H29N3/c1-18-17(10-5-3-6-11-17)12-15-20(2)14-9-16-8-4-7-13-19-16/h4,7-8,13,18H,3,5-6,9-12,14-15H2,1-2H3
InChIKeyNPKLNMHTZWBLCR-UHFFFAOYSA-N
MW275.44 g/mol
LogP2.87
Rot. Bonds7

About N-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine

N-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine (PubChem CID 65241177) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is N-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine.

Molecular Properties

Compound NameN-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine
PubChem CID65241177
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC NameN-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine
SMILESCNC1(CCN(C)CCc2ccccn2)CCCCC1
InChIInChI=1S/C17H29N3/c1-18-17(10-5-3-6-11-17)12-15-20(2)14-9-16-8-4-7-13-19-16/h4,7-8,13,18H,3,5-6,9-12,14-15H2,1-2H3
InChIKeyNPKLNMHTZWBLCR-UHFFFAOYSA-N
XLogP2.87
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(methylamino)cyclohexyl]-N-(2-pyridin-2-ylethyl)acetamide
CID 65240965
1-[[methyl(2-pyridin-2-ylethyl)amino]methyl]cyclopentan-1-ol
CID 65212670
1-[[methyl(2-pyridin-2-ylethyl)amino]methyl]cyclohexane-1-carbaldehyde
CID 62276380
N-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine
CID 21307320
N-[[1-(2-aminoethyl)cyclopropyl]methyl]-N-methyl-2-pyridin-2-ylethanamine
CID 65479518
1-[2-[methyl(pyridin-2-ylmethyl)amino]ethyl]cyclopentan-1-amine
CID 64677728
N-cyclopentyl-N'-methyl-N'-(2-pyridin-2-ylethyl)propane-1,3-diamine
CID 62569303
2-[1-(aminomethyl)cyclohexyl]-N-methyl-N-(pyridin-2-ylmethyl)ethanamine
CID 104678721
N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-pyridin-2-ylethanamine
CID 91831202
3-[methyl(2-pyridin-2-ylethyl)amino]propan-1-ol
CID 43393524
N-(cyclopentylmethyl)-N'-methyl-N'-(2-pyridin-2-ylethyl)ethane-1,2-diamine
CID 62573237
1-cyclopentyl-N,N'-dimethyl-N'-(2-pyridin-2-ylethyl)ethane-1,2-diamine
CID 104744569

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine?
The IUPAC name of N-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine (CID 65241177) is N-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine.
What is the SMILES notation for N-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine?
The canonical SMILES for N-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine is CNC1(CCN(C)CCc2ccccn2)CCCCC1.
What is the InChIKey of N-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine?
The InChIKey is NPKLNMHTZWBLCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-18-17(10-5-3-6-11-17)12-15-20(2)14-9-16-8-4-7-13-19-16/h4,7-8,13,18H,3,5-6,9-12,14-15H2,1-2H3.
What are the key properties of N-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine?
N-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine has a molecular weight of 275.44 g/mol, XLogP of 2.87, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-[methyl(2-pyridin-2-ylethyl)amino]ethyl]cyclohexan-1-amine is sourced from PubChem (CID 65241177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).