N-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine

C17H23N3 — CID 62286623

IUPACN-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine
SMILESCC(C)CNCc1ccnc(N(C)c2ccccc2)c1
InChIInChI=1S/C17H23N3/c1-14(2)12-18-13-15-9-10-19-17(11-15)20(3)16-7-5-4-6-8-16/h4-11,14,18H,12-13H2,1-3H3
InChIKeyLQHIFKYGCUCUJE-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.60
Rot. Bonds6

About N-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine

N-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine (PubChem CID 62286623) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine.

Molecular Properties

Compound NameN-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine
PubChem CID62286623
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC NameN-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine
SMILESCC(C)CNCc1ccnc(N(C)c2ccccc2)c1
InChIInChI=1S/C17H23N3/c1-14(2)12-18-13-15-9-10-19-17(11-15)20(3)16-7-5-4-6-8-16/h4-11,14,18H,12-13H2,1-3H3
InChIKeyLQHIFKYGCUCUJE-UHFFFAOYSA-N
XLogP3.60
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 ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-fluorophenyl)-N-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62292926
N-cyclopentyl-N-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62280559
N-methyl-2-[(2-methylpropylamino)methyl]-N-phenylpyridin-4-amine
CID 62284741
N-methyl-4-[(2-methylpropylamino)methyl]-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 62282252
N,N,N'-trimethyl-N'-[4-[(2-methylpropylamino)methyl]-2-pyridinyl]propane-1,3-diamine
CID 63699684
N-methyl-4-[(2-methylpropylamino)methyl]-N-(1-thiophen-2-ylethyl)pyridin-2-amine
CID 62281991
N-ethyl-N-(2-methoxyethyl)-4-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62294097
N'-ethyl-N,N-dimethyl-N'-[4-[(2-methylpropylamino)methyl]-2-pyridinyl]propane-1,3-diamine
CID 102997386
N-methyl-4-[(2-methylpropylamino)methyl]-N-(1-methylsulfanylbutan-2-yl)pyridin-2-amine
CID 115987705
4-[(2-methylpropylamino)methyl]-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridin-2-amine
CID 62284039
N-methyl-N-(2-methyloxolan-3-yl)-4-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 82754507
N-(3-fluorophenyl)-N-methyl-4-(methylaminomethyl)pyridin-2-amine
CID 62295394

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine?
The IUPAC name of N-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine (CID 62286623) is N-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine.
What is the SMILES notation for N-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine?
The canonical SMILES for N-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine is CC(C)CNCc1ccnc(N(C)c2ccccc2)c1.
What is the InChIKey of N-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine?
The InChIKey is LQHIFKYGCUCUJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-14(2)12-18-13-15-9-10-19-17(11-15)20(3)16-7-5-4-6-8-16/h4-11,14,18H,12-13H2,1-3H3.
What are the key properties of N-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine?
N-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine has a molecular weight of 269.39 g/mol, XLogP of 3.60, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine is sourced from PubChem (CID 62286623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).