N,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine

C16H22N4 — CID 80629000

IUPACN,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine
SMILESCNCc1cnc(N(C)CCc2ccccn2)c(C)c1
InChIInChI=1S/C16H22N4/c1-13-10-14(11-17-2)12-19-16(13)20(3)9-7-15-6-4-5-8-18-15/h4-6,8,10,12,17H,7,9,11H2,1-3H3
InChIKeyQBAHKEQGTHNFJW-UHFFFAOYSA-N
MW270.38 g/mol
LogP2.18
Rot. Bonds6

About N,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine

N,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine (PubChem CID 80629000) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is N,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine.

Molecular Properties

Compound NameN,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine
PubChem CID80629000
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC NameN,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine
SMILESCNCc1cnc(N(C)CCc2ccccn2)c(C)c1
InChIInChI=1S/C16H22N4/c1-13-10-14(11-17-2)12-19-16(13)20(3)9-7-15-6-4-5-8-18-15/h4-6,8,10,12,17H,7,9,11H2,1-3H3
InChIKeyQBAHKEQGTHNFJW-UHFFFAOYSA-N
XLogP2.18
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-3-methyl-5-(methylaminomethyl)-N-(pyridin-2-ylmethyl)pyridin-2-amine
CID 80635618
N,3-dimethyl-5-(methylaminomethyl)-N-(2-methylsulfonylethyl)pyridin-2-amine
CID 80635616
N-(3-methoxypropyl)-N,3-dimethyl-5-(methylaminomethyl)pyridin-2-amine
CID 80636357
5-(aminomethyl)-N,3-dimethyl-N-(2-phenylethyl)pyridin-2-amine
CID 80636098
N-methyl-N-[[4-(methylaminomethyl)phenyl]methyl]-2-pyridin-2-ylethanamine
CID 62419205
N-methyl-6-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridazin-3-amine
CID 55055145
[3-methyl-4-[methyl(2-pyridin-2-ylethyl)amino]phenyl]methanol
CID 62121542
4-(bromomethyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)aniline
CID 107079644
5-(aminomethyl)-N,3-dimethyl-N-(2-pyridin-4-ylethyl)pyridin-2-amine
CID 80630342
4-N,6-N,2,5-tetramethyl-4-N-(2-pyridin-2-ylethyl)pyrimidine-4,6-diamine
CID 80766493
N,3-dimethyl-5-(methylaminomethyl)-N-[(5-methylfuran-2-yl)methyl]pyridin-2-amine
CID 80630644
3-chloro-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-4-ylethyl)pyridin-2-amine
CID 62281580

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine?
The IUPAC name of N,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine (CID 80629000) is N,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine.
What is the SMILES notation for N,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine?
The canonical SMILES for N,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine is CNCc1cnc(N(C)CCc2ccccn2)c(C)c1.
What is the InChIKey of N,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine?
The InChIKey is QBAHKEQGTHNFJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4/c1-13-10-14(11-17-2)12-19-16(13)20(3)9-7-15-6-4-5-8-18-15/h4-6,8,10,12,17H,7,9,11H2,1-3H3.
What are the key properties of N,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine?
N,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine has a molecular weight of 270.38 g/mol, XLogP of 2.18, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)pyridin-2-amine is sourced from PubChem (CID 80629000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).