N-(1-cyclopropylethyl)-3-methoxypyridin-2-amine

C11H16N2O — CID 115923060

IUPACN-(1-cyclopropylethyl)-3-methoxypyridin-2-amine
SMILESCOc1cccnc1NC(C)C1CC1
InChIInChI=1S/C11H16N2O/c1-8(9-5-6-9)13-11-10(14-2)4-3-7-12-11/h3-4,7-9H,5-6H2,1-2H3,(H,12,13)
InChIKeyIFORYDZXMNBSGC-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.30
Rot. Bonds4

About N-(1-cyclopropylethyl)-3-methoxypyridin-2-amine

N-(1-cyclopropylethyl)-3-methoxypyridin-2-amine (PubChem CID 115923060) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-3-methoxypyridin-2-amine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-3-methoxypyridin-2-amine
PubChem CID115923060
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC NameN-(1-cyclopropylethyl)-3-methoxypyridin-2-amine
SMILESCOc1cccnc1NC(C)C1CC1
InChIInChI=1S/C11H16N2O/c1-8(9-5-6-9)13-11-10(14-2)4-3-7-12-11/h3-4,7-9H,5-6H2,1-2H3,(H,12,13)
InChIKeyIFORYDZXMNBSGC-UHFFFAOYSA-N
XLogP2.30
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-3-methoxypyridin-2-amine?
The IUPAC name of N-(1-cyclopropylethyl)-3-methoxypyridin-2-amine (CID 115923060) is N-(1-cyclopropylethyl)-3-methoxypyridin-2-amine.
What is the SMILES notation for N-(1-cyclopropylethyl)-3-methoxypyridin-2-amine?
The canonical SMILES for N-(1-cyclopropylethyl)-3-methoxypyridin-2-amine is COc1cccnc1NC(C)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)-3-methoxypyridin-2-amine?
The InChIKey is IFORYDZXMNBSGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-8(9-5-6-9)13-11-10(14-2)4-3-7-12-11/h3-4,7-9H,5-6H2,1-2H3,(H,12,13).
What are the key properties of N-(1-cyclopropylethyl)-3-methoxypyridin-2-amine?
N-(1-cyclopropylethyl)-3-methoxypyridin-2-amine has a molecular weight of 192.26 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-3-methoxypyridin-2-amine is sourced from PubChem (CID 115923060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).