4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine

C17H22N2 — CID 83166590

IUPAC4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine
SMILESCC(C)c1ccc(-c2ccncc2N)c(C(C)C)c1
InChIInChI=1S/C17H22N2/c1-11(2)13-5-6-14(16(9-13)12(3)4)15-7-8-19-10-17(15)18/h5-12H,18H2,1-4H3
InChIKeyBZNOQGLYPBZELE-UHFFFAOYSA-N
MW254.38 g/mol
LogP4.58
Rot. Bonds3

About 4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine

4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine (PubChem CID 83166590) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is 4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine.

Molecular Properties

Compound Name4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine
PubChem CID83166590
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC Name4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine
SMILESCC(C)c1ccc(-c2ccncc2N)c(C(C)C)c1
InChIInChI=1S/C17H22N2/c1-11(2)13-5-6-14(16(9-13)12(3)4)15-7-8-19-10-17(15)18/h5-12H,18H2,1-4H3
InChIKeyBZNOQGLYPBZELE-UHFFFAOYSA-N
XLogP4.58
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2,4-di(propan-2-yl)phenyl]pyridine-4-carboxylic acid
CID 66474068
4-(1-methyl-3-propan-2-ylpyrazol-4-yl)pyridin-3-amine
CID 83166773
4-(2,4-dimethylphenyl)pyridin-3-amine
CID 80503034
2,4-di(propan-2-yl)-1-(4-propan-2-ylphenyl)benzene
CID 22103899
4-[(4-propan-2-ylphenyl)methylsulfanyl]pyridin-3-amine
CID 43300028
4-(3-methyltriazol-4-yl)pyridin-3-amine
CID 90205469
4-(2,3,4,5,6-pentamethylphenyl)pyridin-3-amine
CID 83167693
(1S,2S)-1-amino-1-(3-amino-4-pyridinyl)propan-2-ol
CID 55293070
3-(3-amino-4-pyridinyl)pentane-1,4-diamine
CID 90212207
4-(3-chloro-4-methylphenyl)pyridin-3-amine
CID 83166863
1-[2,4-di(propan-2-yl)phenyl]-2-methyl-1H-pyrrolo[3,4-c]pyridin-2-ium-3-amine;ethane;1-methylpiperidine
CID 167492847
4-[4-(3-propan-2-ylphenyl)piperazin-1-yl]pyridin-3-amine
CID 3060369

Frequently Asked Questions

What is the IUPAC name of 4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine?
The IUPAC name of 4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine (CID 83166590) is 4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine.
What is the SMILES notation for 4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine?
The canonical SMILES for 4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine is CC(C)c1ccc(-c2ccncc2N)c(C(C)C)c1.
What is the InChIKey of 4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine?
The InChIKey is BZNOQGLYPBZELE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-11(2)13-5-6-14(16(9-13)12(3)4)15-7-8-19-10-17(15)18/h5-12H,18H2,1-4H3.
What are the key properties of 4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine?
4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine has a molecular weight of 254.38 g/mol, XLogP of 4.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2,4-di(propan-2-yl)phenyl]pyridin-3-amine is sourced from PubChem (CID 83166590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).