6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine

C14H14ClN3O2 — CID 64601345

IUPAC6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine
SMILESNc1ccc(Oc2cncc(Cl)c2)nc1OCC1CC1
InChIInChI=1S/C14H14ClN3O2/c15-10-5-11(7-17-6-10)20-13-4-3-12(16)14(18-13)19-8-9-1-2-9/h3-7,9H,1-2,8,16H2
InChIKeyIYVJZRMURXQPCE-UHFFFAOYSA-N
MW291.74 g/mol
LogP3.29
Rot. Bonds5

About 6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine

6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine (PubChem CID 64601345) has the molecular formula C14H14ClN3O2 and a molecular weight of 291.74 g/mol. Its IUPAC name is 6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine.

Molecular Properties

Compound Name6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine
PubChem CID64601345
Molecular FormulaC14H14ClN3O2
Molecular Weight291.74 g/mol
Exact Mass291.08
IUPAC Name6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine
SMILESNc1ccc(Oc2cncc(Cl)c2)nc1OCC1CC1
InChIInChI=1S/C14H14ClN3O2/c15-10-5-11(7-17-6-10)20-13-4-3-12(16)14(18-13)19-8-9-1-2-9/h3-7,9H,1-2,8,16H2
InChIKeyIYVJZRMURXQPCE-UHFFFAOYSA-N
XLogP3.29
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine?
The IUPAC name of 6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine (CID 64601345) is 6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine.
What is the SMILES notation for 6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine?
The canonical SMILES for 6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine is Nc1ccc(Oc2cncc(Cl)c2)nc1OCC1CC1.
What is the InChIKey of 6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine?
The InChIKey is IYVJZRMURXQPCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O2/c15-10-5-11(7-17-6-10)20-13-4-3-12(16)14(18-13)19-8-9-1-2-9/h3-7,9H,1-2,8,16H2.
What are the key properties of 6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine?
6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine has a molecular weight of 291.74 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-chloro-3-pyridinyl)oxy]-2-(cyclopropylmethoxy)pyridin-3-amine is sourced from PubChem (CID 64601345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).