N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine

C17H29N3 — CID 62257869

IUPACN-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine
SMILESCCNCC1(CN(C)Cc2ccccn2)CCCCC1
InChIInChI=1S/C17H29N3/c1-3-18-14-17(10-6-4-7-11-17)15-20(2)13-16-9-5-8-12-19-16/h5,8-9,12,18H,3-4,6-7,10-11,13-15H2,1-2H3
InChIKeyVXSPMQPLNOZALM-UHFFFAOYSA-N
MW275.44 g/mol
LogP3.07
Rot. Bonds7

About N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine

N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine (PubChem CID 62257869) has the molecular formula C17H29N3 and a molecular weight of 275.44 g/mol. Its IUPAC name is N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine
PubChem CID62257869
Molecular FormulaC17H29N3
Molecular Weight275.44 g/mol
Exact Mass275.24
IUPAC NameN-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine
SMILESCCNCC1(CN(C)Cc2ccccn2)CCCCC1
InChIInChI=1S/C17H29N3/c1-3-18-14-17(10-6-4-7-11-17)15-20(2)13-16-9-5-8-12-19-16/h5,8-9,12,18H,3-4,6-7,10-11,13-15H2,1-2H3
InChIKeyVXSPMQPLNOZALM-UHFFFAOYSA-N
XLogP3.07
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 ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine with MolForge

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Related Compounds

N-methyl-N-[[1-(methylaminomethyl)cyclobutyl]methyl]-1-pyridin-2-ylmethanamine
CID 115246245
1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 43565091
N-[[1-[[(2-methoxyphenyl)methyl-methylamino]methyl]cyclopentyl]methyl]ethanamine
CID 62259078
2-[1-(aminomethyl)cyclohexyl]-N-methyl-N-(pyridin-2-ylmethyl)ethanamine
CID 104678721
N-methyl-N-[(3-propylpyrrolidin-3-yl)methyl]-1-pyridin-2-ylmethanamine
CID 55167085
N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine
CID 83074255
N-[[4-(aminomethyl)oxan-4-yl]methyl]-N-methyl-1-pyridin-2-ylmethanamine
CID 62390958
N-[[1-[[(5-chlorothiophen-2-yl)methyl-methylamino]methyl]cyclohexyl]methyl]ethanamine
CID 63494041
N-[[1-(ethylaminomethyl)cyclopentyl]methyl]-N-methylaniline
CID 55051657
N-[[1-[[methyl(thiophen-3-ylmethyl)amino]methyl]cyclopentyl]methyl]ethanamine
CID 62257148
N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 174963433
ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
CID 145471467

Frequently Asked Questions

What is the IUPAC name of N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine?
The IUPAC name of N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine (CID 62257869) is N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine.
What is the SMILES notation for N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine?
The canonical SMILES for N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine is CCNCC1(CN(C)Cc2ccccn2)CCCCC1.
What is the InChIKey of N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine?
The InChIKey is VXSPMQPLNOZALM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3/c1-3-18-14-17(10-6-4-7-11-17)15-20(2)13-16-9-5-8-12-19-16/h5,8-9,12,18H,3-4,6-7,10-11,13-15H2,1-2H3.
What are the key properties of N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine?
N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine has a molecular weight of 275.44 g/mol, XLogP of 3.07, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexyl]methyl]ethanamine is sourced from PubChem (CID 62257869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).