(Z)-1-phenyl-N-pyrrol-1-ylmethanimine

C11H10N2 — CID 5374198

IUPAC(Z)-1-phenyl-N-pyrrol-1-ylmethanimine
SMILESC(=N\n1cccc1)\c1ccccc1
InChIInChI=1S/C11H10N2/c1-2-6-11(7-3-1)10-12-13-8-4-5-9-13/h1-10H/b12-10-
InChIKeyJMDUMQQSLQIVJO-BENRWUELSA-N
MW170.22 g/mol
LogP2.37
Rot. Bonds2

About (Z)-1-phenyl-N-pyrrol-1-ylmethanimine

(Z)-1-phenyl-N-pyrrol-1-ylmethanimine (PubChem CID 5374198) has the molecular formula C11H10N2 and a molecular weight of 170.22 g/mol. Its IUPAC name is (Z)-1-phenyl-N-pyrrol-1-ylmethanimine.

Molecular Properties

Compound Name(Z)-1-phenyl-N-pyrrol-1-ylmethanimine
PubChem CID5374198
Molecular FormulaC11H10N2
Molecular Weight170.22 g/mol
Exact Mass170.08
IUPAC Name(Z)-1-phenyl-N-pyrrol-1-ylmethanimine
SMILESC(=N\n1cccc1)\c1ccccc1
InChIInChI=1S/C11H10N2/c1-2-6-11(7-3-1)10-12-13-8-4-5-9-13/h1-10H/b12-10-
InChIKeyJMDUMQQSLQIVJO-BENRWUELSA-N
XLogP2.37
TPSA17.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.22
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(benzylideneamino)imidazol-3-ium-1-yl]-1-phenylmethanimine
CID 54336771
(E)-N-pyrrol-1-yl-1-(1H-pyrrol-3-yl)methanimine
CID 137270851
(E)-N-(4-methylimidazol-1-yl)-1-phenylmethanimine
CID 19862556
(Z)-1-(4-phenylphenyl)-N-(1,2,4-triazol-4-yl)methanimine
CID 5425371
3-[(E)-benzylideneamino]-1,3-oxazol-2-one
CID 18529193
(E)-N-(2,3-dimethylimidazol-3-ium-1-yl)-1-phenylmethanimine
CID 22167387
N-oxido-1-phenylmethanimine
CID 3712496
ethane;N-methyl-1-phenylmethanimine
CID 90887000
(E)-N-[(4R,5S)-3-[(E)-benzylideneamino]-2-methyl-4,5-diphenylimidazolidin-1-yl]-1-phenylmethanimine
CID 92858993
(E)-N-[(4R,5S)-3-[(Z)-benzylideneamino]-2-methyl-4,5-diphenylimidazolidin-1-yl]-1-phenylmethanimine
CID 92529360
N-(6-bromopyrrolo[3,2-b]pyridin-1-yl)-1-phenylmethanimine
CID 67459369
N,1-diphenylmethanimine
CID 10858

Frequently Asked Questions

What is the IUPAC name of (Z)-1-phenyl-N-pyrrol-1-ylmethanimine?
The IUPAC name of (Z)-1-phenyl-N-pyrrol-1-ylmethanimine (CID 5374198) is (Z)-1-phenyl-N-pyrrol-1-ylmethanimine.
What is the SMILES notation for (Z)-1-phenyl-N-pyrrol-1-ylmethanimine?
The canonical SMILES for (Z)-1-phenyl-N-pyrrol-1-ylmethanimine is C(=N\n1cccc1)\c1ccccc1.
What is the InChIKey of (Z)-1-phenyl-N-pyrrol-1-ylmethanimine?
The InChIKey is JMDUMQQSLQIVJO-BENRWUELSA-N. The full InChI is InChI=1S/C11H10N2/c1-2-6-11(7-3-1)10-12-13-8-4-5-9-13/h1-10H/b12-10-.
What are the key properties of (Z)-1-phenyl-N-pyrrol-1-ylmethanimine?
(Z)-1-phenyl-N-pyrrol-1-ylmethanimine has a molecular weight of 170.22 g/mol, XLogP of 2.37, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-phenyl-N-pyrrol-1-ylmethanimine is sourced from PubChem (CID 5374198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).