5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine

C13H14N2 — CID 143815729

IUPAC5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine
SMILESC=CC1=C(N(C)C)C(=C)c2ncccc21
InChIInChI=1S/C13H14N2/c1-5-10-11-7-6-8-14-12(11)9(2)13(10)15(3)4/h5-8H,1-2H2,3-4H3
InChIKeyCVJRQJULCIKWPN-UHFFFAOYSA-N
MW198.27 g/mol
LogP2.57
Rot. Bonds2

About 5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine

5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine (PubChem CID 143815729) has the molecular formula C13H14N2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine.

Molecular Properties

Compound Name5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine
PubChem CID143815729
Molecular FormulaC13H14N2
Molecular Weight198.27 g/mol
Exact Mass198.12
IUPAC Name5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine
SMILESC=CC1=C(N(C)C)C(=C)c2ncccc21
InChIInChI=1S/C13H14N2/c1-5-10-11-7-6-8-14-12(11)9(2)13(10)15(3)4/h5-8H,1-2H2,3-4H3
InChIKeyCVJRQJULCIKWPN-UHFFFAOYSA-N
XLogP2.57
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine?
The IUPAC name of 5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine (CID 143815729) is 5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine.
What is the SMILES notation for 5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine?
The canonical SMILES for 5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine is C=CC1=C(N(C)C)C(=C)c2ncccc21.
What is the InChIKey of 5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine?
The InChIKey is CVJRQJULCIKWPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2/c1-5-10-11-7-6-8-14-12(11)9(2)13(10)15(3)4/h5-8H,1-2H2,3-4H3.
What are the key properties of 5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine?
5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine has a molecular weight of 198.27 g/mol, XLogP of 2.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-N,N-dimethyl-7-methylidenecyclopenta[b]pyridin-6-amine is sourced from PubChem (CID 143815729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).