(2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine

C9H15N3 — CID 155055383

IUPAC(2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine
SMILESCC(C)C1=C/C(=C/N)N(N)C=C1
InChIInChI=1S/C9H15N3/c1-7(2)8-3-4-12(11)9(5-8)6-10/h3-7H,10-11H2,1-2H3/b9-6-
InChIKeyYDHLRPHOIKXKQL-TWGQIWQCSA-N
MW165.24 g/mol
LogP1.07
Rot. Bonds1

About (2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine

(2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine (PubChem CID 155055383) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is (2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine.

Molecular Properties

Compound Name(2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine
PubChem CID155055383
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name(2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine
SMILESCC(C)C1=C/C(=C/N)N(N)C=C1
InChIInChI=1S/C9H15N3/c1-7(2)8-3-4-12(11)9(5-8)6-10/h3-7H,10-11H2,1-2H3/b9-6-
InChIKeyYDHLRPHOIKXKQL-TWGQIWQCSA-N
XLogP1.07
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine?
The IUPAC name of (2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine (CID 155055383) is (2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine.
What is the SMILES notation for (2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine?
The canonical SMILES for (2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine is CC(C)C1=C/C(=C/N)N(N)C=C1.
What is the InChIKey of (2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine?
The InChIKey is YDHLRPHOIKXKQL-TWGQIWQCSA-N. The full InChI is InChI=1S/C9H15N3/c1-7(2)8-3-4-12(11)9(5-8)6-10/h3-7H,10-11H2,1-2H3/b9-6-.
What are the key properties of (2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine?
(2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine has a molecular weight of 165.24 g/mol, XLogP of 1.07, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(aminomethylidene)-4-propan-2-ylpyridin-1-amine is sourced from PubChem (CID 155055383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).