1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol

C17H22N2O — CID 80527008

IUPAC1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol
SMILESNCC(c1ccccn1)C(O)CCCc1ccccc1
InChIInChI=1S/C17H22N2O/c18-13-15(16-10-4-5-12-19-16)17(20)11-6-9-14-7-2-1-3-8-14/h1-5,7-8,10,12,15,17,20H,6,9,11,13,18H2
InChIKeyRPNPOEVOKHOKKR-UHFFFAOYSA-N
MW270.38 g/mol
LogP2.51
Rot. Bonds7

About 1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol

1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol (PubChem CID 80527008) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol.

Molecular Properties

Compound Name1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol
PubChem CID80527008
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol
SMILESNCC(c1ccccn1)C(O)CCCc1ccccc1
InChIInChI=1S/C17H22N2O/c18-13-15(16-10-4-5-12-19-16)17(20)11-6-9-14-7-2-1-3-8-14/h1-5,7-8,10,12,15,17,20H,6,9,11,13,18H2
InChIKeyRPNPOEVOKHOKKR-UHFFFAOYSA-N
XLogP2.51
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-2-(2-chlorophenyl)-6-phenylhexan-3-ol
CID 65184766
4-amino-1-cyclopentyl-3-pyridin-2-ylbutan-2-ol
CID 80527107
4-amino-1-pyridin-2-ylbutane-1,2-diol
CID 171880668
5-(aminomethyl)-6-methyl-1-phenylheptan-4-ol
CID 65185188
(2R)-3-methyl-2-pyridin-2-ylbutan-1-amine
CID 96736561
3-amino-1-(4-methylthiophen-3-yl)-2-pyridin-2-ylpropan-1-ol
CID 80525924
(1R)-4-phenyl-1-(1,3-thiazol-2-yl)butan-1-ol
CID 174457838
4-phenyl-1-pyrimidin-4-ylbutan-1-ol
CID 63988109
2-methyl-7-phenylheptane-3,4-diol
CID 103456597
3-amino-1-(2-methoxyphenyl)-2-pyridin-2-ylpropan-1-ol
CID 80527197
3-methyl-6-phenylhexan-2-ol
CID 54498182
3-amino-1-(5-chlorothiophen-2-yl)-2-pyridin-2-ylpropan-1-ol
CID 80526991

Frequently Asked Questions

What is the IUPAC name of 1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol?
The IUPAC name of 1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol (CID 80527008) is 1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol.
What is the SMILES notation for 1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol?
The canonical SMILES for 1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol is NCC(c1ccccn1)C(O)CCCc1ccccc1.
What is the InChIKey of 1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol?
The InChIKey is RPNPOEVOKHOKKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c18-13-15(16-10-4-5-12-19-16)17(20)11-6-9-14-7-2-1-3-8-14/h1-5,7-8,10,12,15,17,20H,6,9,11,13,18H2.
What are the key properties of 1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol?
1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol has a molecular weight of 270.38 g/mol, XLogP of 2.51, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-6-phenyl-2-pyridin-2-ylhexan-3-ol is sourced from PubChem (CID 80527008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).