N,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine

C17H23N3 — CID 81247455

IUPACN,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine
SMILESCNCc1cnc(C)cc1N(C)CCc1ccccc1
InChIInChI=1S/C17H23N3/c1-14-11-17(16(12-18-2)13-19-14)20(3)10-9-15-7-5-4-6-8-15/h4-8,11,13,18H,9-10,12H2,1-3H3
InChIKeyZQYMCCGDWDCDNF-UHFFFAOYSA-N
MW269.39 g/mol
LogP2.79
Rot. Bonds6

About N,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine

N,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine (PubChem CID 81247455) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is N,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine.

Molecular Properties

Compound NameN,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine
PubChem CID81247455
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC NameN,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine
SMILESCNCc1cnc(C)cc1N(C)CCc1ccccc1
InChIInChI=1S/C17H23N3/c1-14-11-17(16(12-18-2)13-19-14)20(3)10-9-15-7-5-4-6-8-15/h4-8,11,13,18H,9-10,12H2,1-3H3
InChIKeyZQYMCCGDWDCDNF-UHFFFAOYSA-N
XLogP2.79
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butyl-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine
CID 81249829
N-(2,2-dimethylpropyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine
CID 81246388
4-chloro-N-methyl-2-(methylaminomethyl)-N-(2-phenylethyl)aniline
CID 114851960
N-methyl-4-(methylaminomethyl)-N-(2-pyridin-4-ylethyl)pyridin-3-amine
CID 105073101
N-[[1-(dimethylamino)cyclobutyl]methyl]-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine
CID 105417609
5-(ethylaminomethyl)-N,2-dimethyl-N-propylpyridin-4-amine
CID 81248626
N-butan-2-yl-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine
CID 81249618
N-(3-fluorophenyl)-N,2-dimethyl-5-(methylaminomethyl)pyridin-4-amine
CID 81247042
3-chloro-N-methyl-2-(methylaminomethyl)-N-(2-phenylethyl)aniline
CID 65488208
3-(ethylaminomethyl)-N-methyl-N-(2-phenylethyl)pyridin-4-amine
CID 81248283
N,N,N'-trimethyl-N'-[2-methyl-5-[(propan-2-ylamino)methyl]-4-pyridinyl]propane-1,3-diamine
CID 81247572
N-cyclopropyl-2-methyl-5-(methylaminomethyl)-N-(2-methylpropyl)pyridin-4-amine
CID 81246744

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine?
The IUPAC name of N,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine (CID 81247455) is N,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine.
What is the SMILES notation for N,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine?
The canonical SMILES for N,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine is CNCc1cnc(C)cc1N(C)CCc1ccccc1.
What is the InChIKey of N,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine?
The InChIKey is ZQYMCCGDWDCDNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-14-11-17(16(12-18-2)13-19-14)20(3)10-9-15-7-5-4-6-8-15/h4-8,11,13,18H,9-10,12H2,1-3H3.
What are the key properties of N,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine?
N,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine has a molecular weight of 269.39 g/mol, XLogP of 2.79, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-5-(methylaminomethyl)-N-(2-phenylethyl)pyridin-4-amine is sourced from PubChem (CID 81247455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).