N-(cinnamylideneamino)-N-methylpyridin-2-amine

C15H15N3 — CID 2838692

IUPACN-(cinnamylideneamino)-N-methylpyridin-2-amine
SMILESCN(N=CC=Cc1ccccc1)c1ccccn1
InChIInChI=1S/C15H15N3/c1-18(15-11-5-6-12-16-15)17-13-7-10-14-8-3-2-4-9-14/h2-13H,1H3
InChIKeyMKVZMUNSEWQWKC-UHFFFAOYSA-N
MW237.31 g/mol
LogP3.22
Rot. Bonds4

About N-(cinnamylideneamino)-N-methylpyridin-2-amine

N-(cinnamylideneamino)-N-methylpyridin-2-amine (PubChem CID 2838692) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is N-(cinnamylideneamino)-N-methylpyridin-2-amine.

Molecular Properties

Compound NameN-(cinnamylideneamino)-N-methylpyridin-2-amine
PubChem CID2838692
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC NameN-(cinnamylideneamino)-N-methylpyridin-2-amine
SMILESCN(N=CC=Cc1ccccc1)c1ccccn1
InChIInChI=1S/C15H15N3/c1-18(15-11-5-6-12-16-15)17-13-7-10-14-8-3-2-4-9-14/h2-13H,1H3
InChIKeyMKVZMUNSEWQWKC-UHFFFAOYSA-N
XLogP3.22
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(cinnamylideneamino)-N-methylpyridin-2-amine?
The IUPAC name of N-(cinnamylideneamino)-N-methylpyridin-2-amine (CID 2838692) is N-(cinnamylideneamino)-N-methylpyridin-2-amine.
What is the SMILES notation for N-(cinnamylideneamino)-N-methylpyridin-2-amine?
The canonical SMILES for N-(cinnamylideneamino)-N-methylpyridin-2-amine is CN(N=CC=Cc1ccccc1)c1ccccn1.
What is the InChIKey of N-(cinnamylideneamino)-N-methylpyridin-2-amine?
The InChIKey is MKVZMUNSEWQWKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-18(15-11-5-6-12-16-15)17-13-7-10-14-8-3-2-4-9-14/h2-13H,1H3.
What are the key properties of N-(cinnamylideneamino)-N-methylpyridin-2-amine?
N-(cinnamylideneamino)-N-methylpyridin-2-amine has a molecular weight of 237.31 g/mol, XLogP of 3.22, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cinnamylideneamino)-N-methylpyridin-2-amine is sourced from PubChem (CID 2838692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).