N-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine

C14H14N2 — CID 139435873

IUPACN-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine
SMILESC=NC1=C(/C=C\C)C(C)=c2c1ccnc2=C
InChIInChI=1S/C14H14N2/c1-5-6-11-9(2)13-10(3)16-8-7-12(13)14(11)15-4/h5-8H,3-4H2,1-2H3/b6-5-
InChIKeyDHZTZFYGKGSZFQ-WAYWQWQTSA-N
MW210.28 g/mol
LogP1.66
Rot. Bonds2

About N-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine

N-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine (PubChem CID 139435873) has the molecular formula C14H14N2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine.

Molecular Properties

Compound NameN-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine
PubChem CID139435873
Molecular FormulaC14H14N2
Molecular Weight210.28 g/mol
Exact Mass210.12
IUPAC NameN-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine
SMILESC=NC1=C(/C=C\C)C(C)=c2c1ccnc2=C
InChIInChI=1S/C14H14N2/c1-5-6-11-9(2)13-10(3)16-8-7-12(13)14(11)15-4/h5-8H,3-4H2,1-2H3/b6-5-
InChIKeyDHZTZFYGKGSZFQ-WAYWQWQTSA-N
XLogP1.66
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine?
The IUPAC name of N-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine (CID 139435873) is N-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine.
What is the SMILES notation for N-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine?
The canonical SMILES for N-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine is C=NC1=C(/C=C\C)C(C)=c2c1ccnc2=C.
What is the InChIKey of N-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine?
The InChIKey is DHZTZFYGKGSZFQ-WAYWQWQTSA-N. The full InChI is InChI=1S/C14H14N2/c1-5-6-11-9(2)13-10(3)16-8-7-12(13)14(11)15-4/h5-8H,3-4H2,1-2H3/b6-5-.
What are the key properties of N-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine?
N-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine has a molecular weight of 210.28 g/mol, XLogP of 1.66, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-methyl-1-methylidene-6-[(Z)-prop-1-enyl]cyclopenta[c]pyridin-5-yl]methanimine is sourced from PubChem (CID 139435873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).