N-(2-cyclopropyloxan-4-yl)pyridin-2-amine

C13H18N2O — CID 133473667

IUPACN-(2-cyclopropyloxan-4-yl)pyridin-2-amine
SMILESc1ccc(NC2CCOC(C3CC3)C2)nc1
InChIInChI=1S/C13H18N2O/c1-2-7-14-13(3-1)15-11-6-8-16-12(9-11)10-4-5-10/h1-3,7,10-12H,4-6,8-9H2,(H,14,15)
InChIKeyQLPXFSRXOQBGSU-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.45
Rot. Bonds3

About N-(2-cyclopropyloxan-4-yl)pyridin-2-amine

N-(2-cyclopropyloxan-4-yl)pyridin-2-amine (PubChem CID 133473667) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is N-(2-cyclopropyloxan-4-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-(2-cyclopropyloxan-4-yl)pyridin-2-amine
PubChem CID133473667
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC NameN-(2-cyclopropyloxan-4-yl)pyridin-2-amine
SMILESc1ccc(NC2CCOC(C3CC3)C2)nc1
InChIInChI=1S/C13H18N2O/c1-2-7-14-13(3-1)15-11-6-8-16-12(9-11)10-4-5-10/h1-3,7,10-12H,4-6,8-9H2,(H,14,15)
InChIKeyQLPXFSRXOQBGSU-UHFFFAOYSA-N
XLogP2.45
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyloxan-4-yl)pyridin-2-amine?
The IUPAC name of N-(2-cyclopropyloxan-4-yl)pyridin-2-amine (CID 133473667) is N-(2-cyclopropyloxan-4-yl)pyridin-2-amine.
What is the SMILES notation for N-(2-cyclopropyloxan-4-yl)pyridin-2-amine?
The canonical SMILES for N-(2-cyclopropyloxan-4-yl)pyridin-2-amine is c1ccc(NC2CCOC(C3CC3)C2)nc1.
What is the InChIKey of N-(2-cyclopropyloxan-4-yl)pyridin-2-amine?
The InChIKey is QLPXFSRXOQBGSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-2-7-14-13(3-1)15-11-6-8-16-12(9-11)10-4-5-10/h1-3,7,10-12H,4-6,8-9H2,(H,14,15).
What are the key properties of N-(2-cyclopropyloxan-4-yl)pyridin-2-amine?
N-(2-cyclopropyloxan-4-yl)pyridin-2-amine has a molecular weight of 218.30 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyloxan-4-yl)pyridin-2-amine is sourced from PubChem (CID 133473667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).