2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol

C10H15N3O — CID 63294753

IUPAC2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol
SMILESNc1ccc(NCC(O)C2CC2)cn1
InChIInChI=1S/C10H15N3O/c11-10-4-3-8(5-13-10)12-6-9(14)7-1-2-7/h3-5,7,9,12,14H,1-2,6H2,(H2,11,13)
InChIKeyXEHHTJWIVZTPEG-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.85
Rot. Bonds4

About 2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol

2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol (PubChem CID 63294753) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol.

Molecular Properties

Compound Name2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol
PubChem CID63294753
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol
SMILESNc1ccc(NCC(O)C2CC2)cn1
InChIInChI=1S/C10H15N3O/c11-10-4-3-8(5-13-10)12-6-9(14)7-1-2-7/h3-5,7,9,12,14H,1-2,6H2,(H2,11,13)
InChIKeyXEHHTJWIVZTPEG-UHFFFAOYSA-N
XLogP0.85
TPSA71.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol?
The IUPAC name of 2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol (CID 63294753) is 2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol.
What is the SMILES notation for 2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol?
The canonical SMILES for 2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol is Nc1ccc(NCC(O)C2CC2)cn1.
What is the InChIKey of 2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol?
The InChIKey is XEHHTJWIVZTPEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c11-10-4-3-8(5-13-10)12-6-9(14)7-1-2-7/h3-5,7,9,12,14H,1-2,6H2,(H2,11,13).
What are the key properties of 2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol?
2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol has a molecular weight of 193.25 g/mol, XLogP of 0.85, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-3-pyridinyl)amino]-1-cyclopropylethanol is sourced from PubChem (CID 63294753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).