2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine

C17H23N3O — CID 65484470

IUPAC2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine
SMILESCOc1ccccc1CC(C)N(C)c1ccnc(CN)c1
InChIInChI=1S/C17H23N3O/c1-13(10-14-6-4-5-7-17(14)21-3)20(2)16-8-9-19-15(11-16)12-18/h4-9,11,13H,10,12,18H2,1-3H3
InChIKeyWWUAEOVLPGKDKE-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.62
Rot. Bonds6

About 2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine

2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine (PubChem CID 65484470) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine
PubChem CID65484470
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine
SMILESCOc1ccccc1CC(C)N(C)c1ccnc(CN)c1
InChIInChI=1S/C17H23N3O/c1-13(10-14-6-4-5-7-17(14)21-3)20(2)16-8-9-19-15(11-16)12-18/h4-9,11,13H,10,12,18H2,1-3H3
InChIKeyWWUAEOVLPGKDKE-UHFFFAOYSA-N
XLogP2.62
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(aminomethyl)-N-butan-2-yl-N-methylpyridin-4-amine
CID 62300854
2-N-[1-(2-methoxyphenyl)propan-2-yl]-2-N-methylpyrazine-2,5-diamine
CID 80653405
[2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]-4-pyridinyl]methanol
CID 65487641
2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]pyridine-4-carbonitrile
CID 65485931
4-N-[1-(2-methoxyphenyl)propan-2-yl]-4-N-methylpyridine-3,4-diamine
CID 65485063
4-N-[1-(2-methoxyphenyl)propan-2-yl]-4-N,5-dimethylpyrimidine-4,6-diamine
CID 80829895
4-iodo-1-N-[1-(2-methoxyphenyl)propan-2-yl]-1-N-methylbenzene-1,2-diamine
CID 66080150
2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]pyridine-3-carbonitrile
CID 65488782
5-N-[1-(2-methoxyphenyl)propan-2-yl]-5-N,1,3-trimethylpyrazole-4,5-diamine
CID 65485261
2-iodo-1-N-[1-(2-methoxyphenyl)propan-2-yl]-1-N-methylbenzene-1,4-diamine
CID 66092748
5-bromo-4-N-[1-(2-methoxyphenyl)propan-2-yl]-4-N-methylpyrimidine-2,4-diamine
CID 80829894
3-amino-2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propan-1-ol
CID 104711070

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine?
The IUPAC name of 2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine (CID 65484470) is 2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine.
What is the SMILES notation for 2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine?
The canonical SMILES for 2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine is COc1ccccc1CC(C)N(C)c1ccnc(CN)c1.
What is the InChIKey of 2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine?
The InChIKey is WWUAEOVLPGKDKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-13(10-14-6-4-5-7-17(14)21-3)20(2)16-8-9-19-15(11-16)12-18/h4-9,11,13H,10,12,18H2,1-3H3.
What are the key properties of 2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine?
2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine has a molecular weight of 285.39 g/mol, XLogP of 2.62, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyridin-4-amine is sourced from PubChem (CID 65484470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).