[(2-chloro-3-pyridinyl)amino]methanol;ethane

C10H19ClN2O — CID 158340560

IUPAC[(2-chloro-3-pyridinyl)amino]methanol;ethane
SMILESCC.CC.OCNc1cccnc1Cl
InChIInChI=1S/C6H7ClN2O.2C2H6/c7-6-5(9-4-10)2-1-3-8-6;2*1-2/h1-3,9-10H,4H2;2*1-2H3
InChIKeyGRCNAZWUXIRYRX-UHFFFAOYSA-N
MW218.73 g/mol
LogP3.15
Rot. Bonds2

About [(2-chloro-3-pyridinyl)amino]methanol;ethane

[(2-chloro-3-pyridinyl)amino]methanol;ethane (PubChem CID 158340560) has the molecular formula C10H19ClN2O and a molecular weight of 218.73 g/mol. Its IUPAC name is [(2-chloro-3-pyridinyl)amino]methanol;ethane.

Molecular Properties

Compound Name[(2-chloro-3-pyridinyl)amino]methanol;ethane
PubChem CID158340560
Molecular FormulaC10H19ClN2O
Molecular Weight218.73 g/mol
Exact Mass218.12
IUPAC Name[(2-chloro-3-pyridinyl)amino]methanol;ethane
SMILESCC.CC.OCNc1cccnc1Cl
InChIInChI=1S/C6H7ClN2O.2C2H6/c7-6-5(9-4-10)2-1-3-8-6;2*1-2/h1-3,9-10H,4H2;2*1-2H3
InChIKeyGRCNAZWUXIRYRX-UHFFFAOYSA-N
XLogP3.15
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.73
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-(cyclopropylmethyl)pyridin-3-amine
CID 43690086
N-(2-chloro-3-pyridinyl)-2-(methylamino)acetamide
CID 43222204
4-[(2-chloro-3-pyridinyl)amino]-2,2-dimethyl-4-oxobutanoic acid
CID 65302439
3-[[(2-chloro-3-pyridinyl)amino]methyl]benzene-1,2-diol
CID 61319295
ethyl 3-[(2-chloro-3-pyridinyl)amino]propanoate
CID 82316667
2-chloro-N-[(3-methylphenyl)methyl]pyridin-3-amine
CID 43689842
2-[(2-chloro-3-pyridinyl)amino]propanoic acid
CID 66174310
3-[(2-chloro-3-pyridinyl)amino]-2-methylbutan-2-ol
CID 65338181
2-chloropyridin-3-ol;ethane
CID 144796414
2-(4-bromoanilino)-N-(2-chloro-3-pyridinyl)acetamide
CID 7774992
2-anilino-N-(2-chloro-3-pyridinyl)acetamide
CID 60661396
2-chloro-N-(furan-3-ylmethyl)pyridin-3-amine
CID 63204400

Frequently Asked Questions

What is the IUPAC name of [(2-chloro-3-pyridinyl)amino]methanol;ethane?
The IUPAC name of [(2-chloro-3-pyridinyl)amino]methanol;ethane (CID 158340560) is [(2-chloro-3-pyridinyl)amino]methanol;ethane.
What is the SMILES notation for [(2-chloro-3-pyridinyl)amino]methanol;ethane?
The canonical SMILES for [(2-chloro-3-pyridinyl)amino]methanol;ethane is CC.CC.OCNc1cccnc1Cl.
What is the InChIKey of [(2-chloro-3-pyridinyl)amino]methanol;ethane?
The InChIKey is GRCNAZWUXIRYRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClN2O.2C2H6/c7-6-5(9-4-10)2-1-3-8-6;2*1-2/h1-3,9-10H,4H2;2*1-2H3.
What are the key properties of [(2-chloro-3-pyridinyl)amino]methanol;ethane?
[(2-chloro-3-pyridinyl)amino]methanol;ethane has a molecular weight of 218.73 g/mol, XLogP of 3.15, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-chloro-3-pyridinyl)amino]methanol;ethane is sourced from PubChem (CID 158340560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).