N,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide

C14H16N2O — CID 143911067

IUPACN,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide
SMILESCC1=CC=c2nc(C(=O)N(C)C)ccc2=CC1
InChIInChI=1S/C14H16N2O/c1-10-4-6-11-7-9-13(14(17)16(2)3)15-12(11)8-5-10/h5-9H,4H2,1-3H3
InChIKeyMUZDHRBPOXTWNJ-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.69
Rot. Bonds1

About N,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide

N,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide (PubChem CID 143911067) has the molecular formula C14H16N2O and a molecular weight of 228.29 g/mol. Its IUPAC name is N,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide.

Molecular Properties

Compound NameN,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide
PubChem CID143911067
Molecular FormulaC14H16N2O
Molecular Weight228.29 g/mol
Exact Mass228.13
IUPAC NameN,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide
SMILESCC1=CC=c2nc(C(=O)N(C)C)ccc2=CC1
InChIInChI=1S/C14H16N2O/c1-10-4-6-11-7-9-13(14(17)16(2)3)15-12(11)8-5-10/h5-9H,4H2,1-3H3
InChIKeyMUZDHRBPOXTWNJ-UHFFFAOYSA-N
XLogP0.69
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide?
The IUPAC name of N,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide (CID 143911067) is N,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide.
What is the SMILES notation for N,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide?
The canonical SMILES for N,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide is CC1=CC=c2nc(C(=O)N(C)C)ccc2=CC1.
What is the InChIKey of N,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide?
The InChIKey is MUZDHRBPOXTWNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-10-4-6-11-7-9-13(14(17)16(2)3)15-12(11)8-5-10/h5-9H,4H2,1-3H3.
What are the key properties of N,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide?
N,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide has a molecular weight of 228.29 g/mol, XLogP of 0.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,7-trimethyl-6H-cyclohepta[b]pyridine-2-carboxamide is sourced from PubChem (CID 143911067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).