(2R)-2,3-diaminopropan-1-ol

C3H10N2O — CID 14151408

IUPAC(2R)-2,3-diaminopropan-1-ol
SMILESNC[C@@H](N)CO
InChIInChI=1S/C3H10N2O/c4-1-3(5)2-6/h3,6H,1-2,4-5H2/t3-/m1/s1
InChIKeyQHBWSLQUJMHGDB-GSVOUGTGSA-N
MW90.13 g/mol
LogP-1.74
Rot. Bonds2

About (2R)-2,3-diaminopropan-1-ol

(2R)-2,3-diaminopropan-1-ol (PubChem CID 14151408) has the molecular formula C3H10N2O and a molecular weight of 90.13 g/mol. Its IUPAC name is (2R)-2,3-diaminopropan-1-ol.

Molecular Properties

Compound Name(2R)-2,3-diaminopropan-1-ol
PubChem CID14151408
Molecular FormulaC3H10N2O
Molecular Weight90.13 g/mol
Exact Mass90.08
IUPAC Name(2R)-2,3-diaminopropan-1-ol
SMILESNC[C@@H](N)CO
InChIInChI=1S/C3H10N2O/c4-1-3(5)2-6/h3,6H,1-2,4-5H2/t3-/m1/s1
InChIKeyQHBWSLQUJMHGDB-GSVOUGTGSA-N
XLogP-1.74
TPSA72.27 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50090.13
LogP ≤ 5-1.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2,3-diaminopropan-1-ol?
The IUPAC name of (2R)-2,3-diaminopropan-1-ol (CID 14151408) is (2R)-2,3-diaminopropan-1-ol.
What is the SMILES notation for (2R)-2,3-diaminopropan-1-ol?
The canonical SMILES for (2R)-2,3-diaminopropan-1-ol is NC[C@@H](N)CO.
What is the InChIKey of (2R)-2,3-diaminopropan-1-ol?
The InChIKey is QHBWSLQUJMHGDB-GSVOUGTGSA-N. The full InChI is InChI=1S/C3H10N2O/c4-1-3(5)2-6/h3,6H,1-2,4-5H2/t3-/m1/s1.
What are the key properties of (2R)-2,3-diaminopropan-1-ol?
(2R)-2,3-diaminopropan-1-ol has a molecular weight of 90.13 g/mol, XLogP of -1.74, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2,3-diaminopropan-1-ol is sourced from PubChem (CID 14151408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).