6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol

C11H16N2O — CID 79794912

IUPAC6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol
SMILESOc1ccc(CNCCC2CC2)nc1
InChIInChI=1S/C11H16N2O/c14-11-4-3-10(13-8-11)7-12-6-5-9-1-2-9/h3-4,8-9,12,14H,1-2,5-7H2
InChIKeySTZXVJXTXNGHEA-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.68
Rot. Bonds5

About 6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol

6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol (PubChem CID 79794912) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol
PubChem CID79794912
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol
SMILESOc1ccc(CNCCC2CC2)nc1
InChIInChI=1S/C11H16N2O/c14-11-4-3-10(13-8-11)7-12-6-5-9-1-2-9/h3-4,8-9,12,14H,1-2,5-7H2
InChIKeySTZXVJXTXNGHEA-UHFFFAOYSA-N
XLogP1.68
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-[(cyclopentylmethylamino)methyl]pyridin-3-ol
CID 79776493
6-[(3,3,3-trifluoropropylamino)methyl]pyridin-3-ol
CID 79793918
6-[(oxolan-3-ylmethylamino)methyl]pyridin-3-ol
CID 79781899
6-[[(3-hydroxycyclohexyl)methylamino]methyl]pyridin-3-ol
CID 113373381
6-[[(1-ethylpiperidin-4-yl)methylamino]methyl]pyridin-3-ol
CID 79783467
6-[(3-methylsulfanylpropylamino)methyl]pyridin-3-ol
CID 79794102
6-[[2-(1,3-thiazol-4-yl)ethylamino]methyl]pyridin-3-ol
CID 79794984
3-[(5-hydroxy-2-pyridinyl)methylamino]-N-methylpropanamide
CID 79783660
6-[(2-phenoxyethylamino)methyl]pyridin-3-ol
CID 79783259
3-[(5-hydroxy-2-pyridinyl)methylamino]-1-pyrrolidin-1-ylpropan-1-one
CID 79775943
6-[(1,3-thiazol-4-ylmethylamino)methyl]pyridin-3-ol
CID 79794983
3-cyclopropyl-N-(1,3-thiazol-4-ylmethyl)propan-1-amine
CID 115639498

Frequently Asked Questions

What is the IUPAC name of 6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol?
The IUPAC name of 6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol (CID 79794912) is 6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol.
What is the SMILES notation for 6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol?
The canonical SMILES for 6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol is Oc1ccc(CNCCC2CC2)nc1.
What is the InChIKey of 6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol?
The InChIKey is STZXVJXTXNGHEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c14-11-4-3-10(13-8-11)7-12-6-5-9-1-2-9/h3-4,8-9,12,14H,1-2,5-7H2.
What are the key properties of 6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol?
6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol has a molecular weight of 192.26 g/mol, XLogP of 1.68, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-cyclopropylethylamino)methyl]pyridin-3-ol is sourced from PubChem (CID 79794912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).