2-(2-methylbutanimidoyl)pyridin-3-amine

C10H15N3 — CID 156796340

IUPAC2-(2-methylbutanimidoyl)pyridin-3-amine
SMILES[H]/N=C(/c1ncccc1N)C(C)CC
InChIInChI=1S/C10H15N3/c1-3-7(2)9(12)10-8(11)5-4-6-13-10/h4-7,12H,3,11H2,1-2H3/b12-9+
InChIKeyPWOOUYIFMHIAKO-FMIVXFBMSA-N
MW177.25 g/mol
LogP2.08
Rot. Bonds3

About 2-(2-methylbutanimidoyl)pyridin-3-amine

2-(2-methylbutanimidoyl)pyridin-3-amine (PubChem CID 156796340) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-(2-methylbutanimidoyl)pyridin-3-amine.

Molecular Properties

Compound Name2-(2-methylbutanimidoyl)pyridin-3-amine
PubChem CID156796340
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name2-(2-methylbutanimidoyl)pyridin-3-amine
SMILES[H]/N=C(/c1ncccc1N)C(C)CC
InChIInChI=1S/C10H15N3/c1-3-7(2)9(12)10-8(11)5-4-6-13-10/h4-7,12H,3,11H2,1-2H3/b12-9+
InChIKeyPWOOUYIFMHIAKO-FMIVXFBMSA-N
XLogP2.08
TPSA62.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylbutanimidoyl)pyridin-3-amine?
The IUPAC name of 2-(2-methylbutanimidoyl)pyridin-3-amine (CID 156796340) is 2-(2-methylbutanimidoyl)pyridin-3-amine.
What is the SMILES notation for 2-(2-methylbutanimidoyl)pyridin-3-amine?
The canonical SMILES for 2-(2-methylbutanimidoyl)pyridin-3-amine is [H]/N=C(/c1ncccc1N)C(C)CC.
What is the InChIKey of 2-(2-methylbutanimidoyl)pyridin-3-amine?
The InChIKey is PWOOUYIFMHIAKO-FMIVXFBMSA-N. The full InChI is InChI=1S/C10H15N3/c1-3-7(2)9(12)10-8(11)5-4-6-13-10/h4-7,12H,3,11H2,1-2H3/b12-9+.
What are the key properties of 2-(2-methylbutanimidoyl)pyridin-3-amine?
2-(2-methylbutanimidoyl)pyridin-3-amine has a molecular weight of 177.25 g/mol, XLogP of 2.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylbutanimidoyl)pyridin-3-amine is sourced from PubChem (CID 156796340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).