(1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol

C8H13N3O — CID 130961552

IUPAC(1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol
SMILESCC(O)[C@H](N)c1cccnc1N
InChIInChI=1S/C8H13N3O/c1-5(12)7(9)6-3-2-4-11-8(6)10/h2-5,7,12H,9H2,1H3,(H2,10,11)/t5?,7-/m0/s1
InChIKeyJDHBJRNWOLQANF-MSZQBOFLSA-N
MW167.21 g/mol
LogP0.04
Rot. Bonds2

About (1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol

(1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol (PubChem CID 130961552) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is (1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol.

Molecular Properties

Compound Name(1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol
PubChem CID130961552
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name(1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol
SMILESCC(O)[C@H](N)c1cccnc1N
InChIInChI=1S/C8H13N3O/c1-5(12)7(9)6-3-2-4-11-8(6)10/h2-5,7,12H,9H2,1H3,(H2,10,11)/t5?,7-/m0/s1
InChIKeyJDHBJRNWOLQANF-MSZQBOFLSA-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

(1S,2S)-1-(2-amino-3-pyridinyl)propane-1,2-diamine
CID 131122997
(1S,2S)-1-amino-1-(2-fluoro-3-pyridinyl)propan-2-ol
CID 55292775
1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol
CID 55292838
3-(1-amino-2,2-dimethoxyethyl)pyridin-2-amine
CID 79492532
(1R,2R)-2-amino-1-(2-amino-3-pyridinyl)butan-1-ol
CID 130848050
3-[(1R)-1-amino-4-methylpentyl]pyridin-2-amine
CID 171211340
3-(1-amino-2-methoxybutyl)pyridin-2-amine
CID 116715178
(2-amino-3-pyridinyl)-(4-propan-2-ylcyclohexyl)methanol
CID 65425477
(1R,2S)-1-amino-1-(2-methylphenyl)propan-2-ol;hydrochloride
CID 171160087
3-[(1S)-1-aminopropyl]pyridin-2-amine;hydrochloride
CID 171230912
3-(1-amino-2-ethoxybutyl)pyridin-2-amine
CID 116716352
1-amino-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)propan-2-ol
CID 55271278

Frequently Asked Questions

What is the IUPAC name of (1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol?
The IUPAC name of (1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol (CID 130961552) is (1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol.
What is the SMILES notation for (1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol?
The canonical SMILES for (1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol is CC(O)[C@H](N)c1cccnc1N.
What is the InChIKey of (1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol?
The InChIKey is JDHBJRNWOLQANF-MSZQBOFLSA-N. The full InChI is InChI=1S/C8H13N3O/c1-5(12)7(9)6-3-2-4-11-8(6)10/h2-5,7,12H,9H2,1H3,(H2,10,11)/t5?,7-/m0/s1.
What are the key properties of (1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol?
(1R)-1-amino-1-(2-amino-3-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 (1R)-1-amino-1-(2-amino-3-pyridinyl)propan-2-ol is sourced from PubChem (CID 130961552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).