ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine

C15H21N3 — CID 145471467

IUPACethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
SMILESCC.CN(Cc1ccccn1)Cc1ccccn1
InChIInChI=1S/C13H15N3.C2H6/c1-16(10-12-6-2-4-8-14-12)11-13-7-3-5-9-15-13;1-2/h2-9H,10-11H2,1H3;1-2H3
InChIKeyDFBSHIZEVFSRKW-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.13
Rot. Bonds4

About ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine

ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine (PubChem CID 145471467) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine.

Molecular Properties

Compound Nameethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
PubChem CID145471467
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Nameethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
SMILESCC.CN(Cc1ccccn1)Cc1ccccn1
InChIInChI=1S/C13H15N3.C2H6/c1-16(10-12-6-2-4-8-14-12)11-13-7-3-5-9-15-13;1-2/h2-9H,10-11H2,1H3;1-2H3
InChIKeyDFBSHIZEVFSRKW-UHFFFAOYSA-N
XLogP3.13
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 174963433
1-(4-bromophenyl)-N-methyl-N-(pyridin-2-ylmethyl)methanamine
CID 60712627
4-[[methyl(pyridin-2-ylmethyl)amino]methyl]aniline
CID 43458236
copper;1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 130339696
N,N-dimethyl-5-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyrimidin-2-amine
CID 75500442
2-methyl-1-[methyl(pyridin-2-ylmethyl)amino]propane-2-thiol
CID 91261751
[3-[[methyl(pyridin-2-ylmethyl)amino]methyl]phenyl]methanamine
CID 43248751
N-methyl-1-naphthalen-2-yl-N-(pyridin-2-ylmethyl)methanamine
CID 171327866
2-(bromomethyl)-2-ethyl-N-methyl-N-(pyridin-2-ylmethyl)butan-1-amine
CID 65003475
N-ethyl-6-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyridin-2-amine
CID 79243794
1-N,2-N,2-trimethyl-1-N-(pyridin-2-ylmethyl)propane-1,2-diamine
CID 62846215
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine
CID 171328140

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine?
The IUPAC name of ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine (CID 145471467) is ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine.
What is the SMILES notation for ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine?
The canonical SMILES for ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine is CC.CN(Cc1ccccn1)Cc1ccccn1.
What is the InChIKey of ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine?
The InChIKey is DFBSHIZEVFSRKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3.C2H6/c1-16(10-12-6-2-4-8-14-12)11-13-7-3-5-9-15-13;1-2/h2-9H,10-11H2,1H3;1-2H3.
What are the key properties of ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine?
ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine has a molecular weight of 243.35 g/mol, XLogP of 3.13, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine is sourced from PubChem (CID 145471467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).