1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol

C12H19N3O2 — CID 43498896

IUPAC1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol
SMILESCC(O)CNc1ccc(N)c(OCC2CC2)n1
InChIInChI=1S/C12H19N3O2/c1-8(16)6-14-11-5-4-10(13)12(15-11)17-7-9-2-3-9/h4-5,8-9,16H,2-3,6-7,13H2,1H3,(H,14,15)
InChIKeyIKIOAXNZWKNHMX-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.25
Rot. Bonds6

About 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol

1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol (PubChem CID 43498896) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol.

Molecular Properties

Compound Name1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol
PubChem CID43498896
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol
SMILESCC(O)CNc1ccc(N)c(OCC2CC2)n1
InChIInChI=1S/C12H19N3O2/c1-8(16)6-14-11-5-4-10(13)12(15-11)17-7-9-2-3-9/h4-5,8-9,16H,2-3,6-7,13H2,1H3,(H,14,15)
InChIKeyIKIOAXNZWKNHMX-UHFFFAOYSA-N
XLogP1.25
TPSA80.40 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol with MolForge

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Related Compounds

1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-3-ethylpentan-2-ol
CID 106284306
4-[[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]methyl]cyclohexan-1-ol
CID 106120160
2-[2-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]ethoxy]ethanol
CID 62498443
3-[2-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]ethyl]-1,1-dimethylurea
CID 83107212
2-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-2-ethylbutan-1-ol
CID 62524145
6-(cyclopropylmethoxy)-2-N-[(6-methyl-2-pyridinyl)methyl]pyridine-2,5-diamine
CID 62323028
2-[(5-amino-6-propoxy-2-pyridinyl)amino]-1-cyclopropylethanol
CID 55172554
6-(cyclopropylmethoxy)-2-N-(2-pyridin-4-ylethyl)pyridine-2,5-diamine
CID 60914941
6-(cyclopropylmethoxy)-2-N-(1-pyridin-2-ylethyl)pyridine-2,5-diamine
CID 43524346
6-(cyclopropylmethoxy)-2-N-[(4,5-dimethylthiophen-2-yl)methyl]pyridine-2,5-diamine
CID 65246368
2-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]-N-ethyl-N-methylpropanamide
CID 103106685
6-(cyclopropylmethoxy)-2-N-phenylpyridine-2,5-diamine
CID 43261281

Frequently Asked Questions

What is the IUPAC name of 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol?
The IUPAC name of 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol (CID 43498896) is 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol.
What is the SMILES notation for 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol?
The canonical SMILES for 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol is CC(O)CNc1ccc(N)c(OCC2CC2)n1.
What is the InChIKey of 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol?
The InChIKey is IKIOAXNZWKNHMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-8(16)6-14-11-5-4-10(13)12(15-11)17-7-9-2-3-9/h4-5,8-9,16H,2-3,6-7,13H2,1H3,(H,14,15).
What are the key properties of 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol?
1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol has a molecular weight of 237.30 g/mol, XLogP of 1.25, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[5-amino-6-(cyclopropylmethoxy)-2-pyridinyl]amino]propan-2-ol is sourced from PubChem (CID 43498896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).