5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine

C17H23N3O — CID 43690659

IUPAC5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine
SMILESCOc1ccc(CC(C)Nc2ccc(N(C)C)nc2)cc1
InChIInChI=1S/C17H23N3O/c1-13(11-14-5-8-16(21-4)9-6-14)19-15-7-10-17(18-12-15)20(2)3/h5-10,12-13,19H,11H2,1-4H3
InChIKeyDSRJUAYZMCVOBI-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.20
Rot. Bonds6

About 5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine

5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine (PubChem CID 43690659) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine.

Molecular Properties

Compound Name5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine
PubChem CID43690659
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine
SMILESCOc1ccc(CC(C)Nc2ccc(N(C)C)nc2)cc1
InChIInChI=1S/C17H23N3O/c1-13(11-14-5-8-16(21-4)9-6-14)19-15-7-10-17(18-12-15)20(2)3/h5-10,12-13,19H,11H2,1-4H3
InChIKeyDSRJUAYZMCVOBI-UHFFFAOYSA-N
XLogP3.20
TPSA37.39 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 ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-[1-(4-methoxyphenyl)propan-2-yl]aniline
CID 43508755
N-[1-(4-fluorophenyl)propan-2-yl]-4-methoxyaniline
CID 115916812
5-N-(1-aminopropan-2-yl)-2-N,2-N-dimethylpyridine-2,5-diamine
CID 103388254
N-[1-(4-methoxyphenyl)propan-2-yl]pyridin-3-amine
CID 43508676
2-N,2-N-dimethyl-5-N-pentan-2-ylpyridine-2,5-diamine
CID 43690557
N-[1-(4-methoxyphenyl)propan-2-yl]-1-propan-2-ylpyrazol-4-amine
CID 62902829
3-ethoxy-N-[1-(4-methoxyphenyl)propan-2-yl]aniline
CID 60936370
N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methoxyphenoxy)acetamide
CID 46699606
5-N-(2,6-dimethylheptan-4-yl)-2-N,2-N-dimethylpyridine-2,5-diamine
CID 43690375
4-methoxy-N-(1-pyridin-2-ylpropan-2-yl)aniline
CID 122394146
5-N-[(3-methoxyphenyl)methyl]-2-N,2-N-dimethylpyridine-2,5-diamine
CID 43690444
N-[1-(4-methoxyphenyl)propan-2-yl]-1,3-thiazol-2-amine
CID 79046617

Frequently Asked Questions

What is the IUPAC name of 5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine?
The IUPAC name of 5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine (CID 43690659) is 5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine.
What is the SMILES notation for 5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine?
The canonical SMILES for 5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine is COc1ccc(CC(C)Nc2ccc(N(C)C)nc2)cc1.
What is the InChIKey of 5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine?
The InChIKey is DSRJUAYZMCVOBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-13(11-14-5-8-16(21-4)9-6-14)19-15-7-10-17(18-12-15)20(2)3/h5-10,12-13,19H,11H2,1-4H3.
What are the key properties of 5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine?
5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine has a molecular weight of 285.39 g/mol, XLogP of 3.20, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[1-(4-methoxyphenyl)propan-2-yl]-2-N,2-N-dimethylpyridine-2,5-diamine is sourced from PubChem (CID 43690659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).