2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol

C18H24N2O — CID 107874941

IUPAC2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol
SMILESCC(C)(C)c1ccc(NC(C)(CO)c2ccccc2)nc1
InChIInChI=1S/C18H24N2O/c1-17(2,3)15-10-11-16(19-12-15)20-18(4,13-21)14-8-6-5-7-9-14/h5-12,21H,13H2,1-4H3,(H,19,20)
InChIKeyXOKCDPLZXOHOID-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.70
Rot. Bonds4

About 2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol

2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol (PubChem CID 107874941) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol.

Molecular Properties

Compound Name2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol
PubChem CID107874941
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol
SMILESCC(C)(C)c1ccc(NC(C)(CO)c2ccccc2)nc1
InChIInChI=1S/C18H24N2O/c1-17(2,3)15-10-11-16(19-12-15)20-18(4,13-21)14-8-6-5-7-9-14/h5-12,21H,13H2,1-4H3,(H,19,20)
InChIKeyXOKCDPLZXOHOID-UHFFFAOYSA-N
XLogP3.70
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5-tert-butyl-2-pyridinyl)amino]-2-ethylbutan-1-ol
CID 107874655
2-[(6-ethoxy-2-pyridinyl)amino]-2-phenylpropan-1-ol
CID 105058536
2-[(5-tert-butyl-2-pyridinyl)amino]-3-phenylpropan-1-ol
CID 107874683
2-[(6-methylsulfanylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol
CID 106973096
5-tert-butyl-N-(1,3-dichloro-2-methylpropan-2-yl)pyridin-2-amine
CID 107875611
(2R)-2-(methylamino)-2-phenylpropan-1-ol
CID 93471124
2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol
CID 105060904
N-(1-chloro-2-phenylpropan-2-yl)-5-fluoropyridin-2-amine
CID 105059589
2-N-(5-tert-butyl-2-pyridinyl)-2-methylbutane-2,3-diamine
CID 114011749
[1-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopropyl]methanol
CID 107874814
2-(isoquinolin-1-ylamino)-2-phenylpropan-1-ol
CID 105058581
2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol
CID 105058433

Frequently Asked Questions

What is the IUPAC name of 2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol?
The IUPAC name of 2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol (CID 107874941) is 2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol.
What is the SMILES notation for 2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol?
The canonical SMILES for 2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol is CC(C)(C)c1ccc(NC(C)(CO)c2ccccc2)nc1.
What is the InChIKey of 2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol?
The InChIKey is XOKCDPLZXOHOID-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-17(2,3)15-10-11-16(19-12-15)20-18(4,13-21)14-8-6-5-7-9-14/h5-12,21H,13H2,1-4H3,(H,19,20).
What are the key properties of 2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol?
2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol has a molecular weight of 284.40 g/mol, XLogP of 3.70, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol is sourced from PubChem (CID 107874941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).