1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol

C11H15N5O — CID 10059875

IUPAC1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol
SMILESNc1cccc(NCC(O)Cn2ccnc2)n1
InChIInChI=1S/C11H15N5O/c12-10-2-1-3-11(15-10)14-6-9(17)7-16-5-4-13-8-16/h1-5,8-9,17H,6-7H2,(H3,12,14,15)
InChIKeyZPEMXPNBDLTNIK-UHFFFAOYSA-N
MW233.28 g/mol
LogP0.33
Rot. Bonds5

About 1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol

1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol (PubChem CID 10059875) has the molecular formula C11H15N5O and a molecular weight of 233.28 g/mol. Its IUPAC name is 1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol.

Molecular Properties

Compound Name1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol
PubChem CID10059875
Molecular FormulaC11H15N5O
Molecular Weight233.28 g/mol
Exact Mass233.13
IUPAC Name1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol
SMILESNc1cccc(NCC(O)Cn2ccnc2)n1
InChIInChI=1S/C11H15N5O/c12-10-2-1-3-11(15-10)14-6-9(17)7-16-5-4-13-8-16/h1-5,8-9,17H,6-7H2,(H3,12,14,15)
InChIKeyZPEMXPNBDLTNIK-UHFFFAOYSA-N
XLogP0.33
TPSA88.99 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 50.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

1-imidazol-1-yl-3-(propan-2-ylamino)propan-2-ol
CID 43165900
1-(2,6-dichlorophenyl)-2-imidazol-1-ylethanol
CID 12760610
2-[(6-amino-2-pyridinyl)amino]ethanol
CID 66907238
(2R)-1-(4-aminophenoxy)-3-imidazol-1-ylpropan-2-ol
CID 7449350
6-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyridine-2,6-diamine
CID 80647967
4-[(6-amino-2-pyridinyl)amino]butan-1-ol
CID 106846869
6-N-(3-methylbutyl)pyridine-2,6-diamine
CID 80647498
N-(2-imidazol-1-ylethyl)-6-methoxypyridin-2-amine
CID 63590047
6-N-[2-(methylamino)ethyl]pyridine-2,6-diamine
CID 10888283
(2R)-1-imidazol-1-yl-3-pyridin-3-yloxypropan-2-ol
CID 58930396
1-carbazol-9-yl-3-imidazol-1-ylpropan-2-ol;ethane
CID 144822333
1-(2-chlorophenyl)-2-imidazol-1-ylethanol
CID 12760607

Frequently Asked Questions

What is the IUPAC name of 1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol?
The IUPAC name of 1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol (CID 10059875) is 1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol.
What is the SMILES notation for 1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol?
The canonical SMILES for 1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol is Nc1cccc(NCC(O)Cn2ccnc2)n1.
What is the InChIKey of 1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol?
The InChIKey is ZPEMXPNBDLTNIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c12-10-2-1-3-11(15-10)14-6-9(17)7-16-5-4-13-8-16/h1-5,8-9,17H,6-7H2,(H3,12,14,15).
What are the key properties of 1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol?
1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol has a molecular weight of 233.28 g/mol, XLogP of 0.33, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6-amino-2-pyridinyl)amino]-3-imidazol-1-ylpropan-2-ol is sourced from PubChem (CID 10059875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).