7-methylpyrido[2,3-c]azepin-7-amine

C10H11N3 — CID 143248604

IUPAC7-methylpyrido[2,3-c]azepin-7-amine
SMILESCC1(N)C=Cc2cccnc2C=N1
InChIInChI=1S/C10H11N3/c1-10(11)5-4-8-3-2-6-12-9(8)7-13-10/h2-7H,11H2,1H3
InChIKeyPGNMJUBANMPGBD-UHFFFAOYSA-N
MW173.22 g/mol
LogP1.20
Rot. Bonds

About 7-methylpyrido[2,3-c]azepin-7-amine

7-methylpyrido[2,3-c]azepin-7-amine (PubChem CID 143248604) has the molecular formula C10H11N3 and a molecular weight of 173.22 g/mol. Its IUPAC name is 7-methylpyrido[2,3-c]azepin-7-amine.

Molecular Properties

Compound Name7-methylpyrido[2,3-c]azepin-7-amine
PubChem CID143248604
Molecular FormulaC10H11N3
Molecular Weight173.22 g/mol
Exact Mass173.10
IUPAC Name7-methylpyrido[2,3-c]azepin-7-amine
SMILESCC1(N)C=Cc2cccnc2C=N1
InChIInChI=1S/C10H11N3/c1-10(11)5-4-8-3-2-6-12-9(8)7-13-10/h2-7H,11H2,1H3
InChIKeyPGNMJUBANMPGBD-UHFFFAOYSA-N
XLogP1.20
TPSA51.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-methylpyrido[2,3-c]azepin-7-amine?
The IUPAC name of 7-methylpyrido[2,3-c]azepin-7-amine (CID 143248604) is 7-methylpyrido[2,3-c]azepin-7-amine.
What is the SMILES notation for 7-methylpyrido[2,3-c]azepin-7-amine?
The canonical SMILES for 7-methylpyrido[2,3-c]azepin-7-amine is CC1(N)C=Cc2cccnc2C=N1.
What is the InChIKey of 7-methylpyrido[2,3-c]azepin-7-amine?
The InChIKey is PGNMJUBANMPGBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3/c1-10(11)5-4-8-3-2-6-12-9(8)7-13-10/h2-7H,11H2,1H3.
What are the key properties of 7-methylpyrido[2,3-c]azepin-7-amine?
7-methylpyrido[2,3-c]azepin-7-amine has a molecular weight of 173.22 g/mol, XLogP of 1.20, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methylpyrido[2,3-c]azepin-7-amine is sourced from PubChem (CID 143248604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).