(2R)-2-hydroxypropanimidamide;hydrochloride

C3H9ClN2O — CID 42614222

IUPAC(2R)-2-hydroxypropanimidamide;hydrochloride
SMILESCl.[H]/N=C(\N)[C@@H](C)O
InChIInChI=1S/C3H8N2O.ClH/c1-2(6)3(4)5;/h2,6H,1H3,(H3,4,5);1H/t2-;/m1./s1
InChIKeyAEOZCEMLLBCHQZ-HSHFZTNMSA-N
MW124.57 g/mol
LogP-0.28
Rot. Bonds1

About (2R)-2-hydroxypropanimidamide;hydrochloride

(2R)-2-hydroxypropanimidamide;hydrochloride (PubChem CID 42614222) has the molecular formula C3H9ClN2O and a molecular weight of 124.57 g/mol. Its IUPAC name is (2R)-2-hydroxypropanimidamide;hydrochloride.

Molecular Properties

Compound Name(2R)-2-hydroxypropanimidamide;hydrochloride
PubChem CID42614222
Molecular FormulaC3H9ClN2O
Molecular Weight124.57 g/mol
Exact Mass124.04
IUPAC Name(2R)-2-hydroxypropanimidamide;hydrochloride
SMILESCl.[H]/N=C(\N)[C@@H](C)O
InChIInChI=1S/C3H8N2O.ClH/c1-2(6)3(4)5;/h2,6H,1H3,(H3,4,5);1H/t2-;/m1./s1
InChIKeyAEOZCEMLLBCHQZ-HSHFZTNMSA-N
XLogP-0.28
TPSA70.10 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.57
LogP ≤ 5-0.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-methylpropanimidamide;hydrochloride
CID 2782053
(1-amino-1-iminopropan-2-yl) carbamimidothioate;dihydrochloride
CID 131862948
2-ethylpropanediimidamide;dihydrochloride
CID 87175836
(2R)-2-methoxypropanimidamide
CID 11768515
N-(1-amino-1-iminopropan-2-yl)acetamide
CID 172748430
2-(disulfanyl)propanimidamide
CID 175395946
(2S)-2-cyclopropylpropanimidamide
CID 95732542
(4-amino-3-hydroxy-4-iminobutan-2-yl) carbamate
CID 175155261
3-(dimethylamino)-2-methylpropanimidamide
CID 43368046
2-fluoro-4-methylpentanimidamide
CID 115011258
[(2S)-4-amino-3-hydroxy-4-iminobutan-2-yl]carbamic acid
CID 118525619
1-hydroxyethyl carbamimidothioate
CID 19790650

Frequently Asked Questions

What is the IUPAC name of (2R)-2-hydroxypropanimidamide;hydrochloride?
The IUPAC name of (2R)-2-hydroxypropanimidamide;hydrochloride (CID 42614222) is (2R)-2-hydroxypropanimidamide;hydrochloride.
What is the SMILES notation for (2R)-2-hydroxypropanimidamide;hydrochloride?
The canonical SMILES for (2R)-2-hydroxypropanimidamide;hydrochloride is Cl.[H]/N=C(\N)[C@@H](C)O.
What is the InChIKey of (2R)-2-hydroxypropanimidamide;hydrochloride?
The InChIKey is AEOZCEMLLBCHQZ-HSHFZTNMSA-N. The full InChI is InChI=1S/C3H8N2O.ClH/c1-2(6)3(4)5;/h2,6H,1H3,(H3,4,5);1H/t2-;/m1./s1.
What are the key properties of (2R)-2-hydroxypropanimidamide;hydrochloride?
(2R)-2-hydroxypropanimidamide;hydrochloride has a molecular weight of 124.57 g/mol, XLogP of -0.28, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-hydroxypropanimidamide;hydrochloride is sourced from PubChem (CID 42614222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).