1-amino-1-(5-amino-2-pyridinyl)propan-2-ol

C8H13N3O — CID 55292549

IUPAC1-amino-1-(5-amino-2-pyridinyl)propan-2-ol
SMILESCC(O)C(N)c1ccc(N)cn1
InChIInChI=1S/C8H13N3O/c1-5(12)8(10)7-3-2-6(9)4-11-7/h2-5,8,12H,9-10H2,1H3
InChIKeyFJQJRWWFAMRJQF-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.04
Rot. Bonds2

About 1-amino-1-(5-amino-2-pyridinyl)propan-2-ol

1-amino-1-(5-amino-2-pyridinyl)propan-2-ol (PubChem CID 55292549) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 1-amino-1-(5-amino-2-pyridinyl)propan-2-ol.

Molecular Properties

Compound Name1-amino-1-(5-amino-2-pyridinyl)propan-2-ol
PubChem CID55292549
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name1-amino-1-(5-amino-2-pyridinyl)propan-2-ol
SMILESCC(O)C(N)c1ccc(N)cn1
InChIInChI=1S/C8H13N3O/c1-5(12)8(10)7-3-2-6(9)4-11-7/h2-5,8,12H,9-10H2,1H3
InChIKeyFJQJRWWFAMRJQF-UHFFFAOYSA-N
XLogP0.04
TPSA85.16 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(1R)-1-amino-2-methylpropyl]pyridin-3-amine
CID 55218698
6-[(1R,2S)-1-amino-2-hydroxypropyl]pyridine-3-carbonitrile
CID 55294065
6-[(1S)-1-aminobutyl]pyridin-3-amine
CID 130738853
methyl 3-(5-amino-2-pyridinyl)-2,3-dihydroxypropanoate
CID 171863534
6-[(1R)-1-amino-2,2,2-trifluoroethyl]pyridin-3-amine
CID 55274249
6-(1-amino-2-methylpropyl)pyridin-3-ol
CID 55294242
6-(1-amino-2,2,2-trifluoroethyl)pyridin-3-amine
CID 55271042
2-(5-amino-2-pyridinyl)butanoic acid
CID 67099005
(1S,2R)-1-amino-1-(6-amino-2-pyridinyl)propan-2-ol
CID 130815832
methyl 4-(5-amino-2-pyridinyl)-3,4-dihydroxybutanoate
CID 171895049
(1S,2S)-1-amino-1-(5-amino-3-pyridinyl)propan-2-ol
CID 55291623
1-amino-1-(1,2-oxazol-3-yl)propan-2-ol
CID 82417981

Frequently Asked Questions

What is the IUPAC name of 1-amino-1-(5-amino-2-pyridinyl)propan-2-ol?
The IUPAC name of 1-amino-1-(5-amino-2-pyridinyl)propan-2-ol (CID 55292549) is 1-amino-1-(5-amino-2-pyridinyl)propan-2-ol.
What is the SMILES notation for 1-amino-1-(5-amino-2-pyridinyl)propan-2-ol?
The canonical SMILES for 1-amino-1-(5-amino-2-pyridinyl)propan-2-ol is CC(O)C(N)c1ccc(N)cn1.
What is the InChIKey of 1-amino-1-(5-amino-2-pyridinyl)propan-2-ol?
The InChIKey is FJQJRWWFAMRJQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-5(12)8(10)7-3-2-6(9)4-11-7/h2-5,8,12H,9-10H2,1H3.
What are the key properties of 1-amino-1-(5-amino-2-pyridinyl)propan-2-ol?
1-amino-1-(5-amino-2-pyridinyl)propan-2-ol has a molecular weight of 167.21 g/mol, XLogP of 0.04, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-1-(5-amino-2-pyridinyl)propan-2-ol is sourced from PubChem (CID 55292549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).