N-phenylformamide;pyrrolidine

C11H16N2O — CID 19102236

IUPACN-phenylformamide;pyrrolidine
SMILESC1CCNC1.O=CNc1ccccc1
InChIInChI=1S/C7H7NO.C4H9N/c9-6-8-7-4-2-1-3-5-7;1-2-4-5-3-1/h1-6H,(H,8,9);5H,1-4H2
InChIKeyNCBYXWPTVVLITQ-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.62
Rot. Bonds2

About N-phenylformamide;pyrrolidine

N-phenylformamide;pyrrolidine (PubChem CID 19102236) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is N-phenylformamide;pyrrolidine.

Molecular Properties

Compound NameN-phenylformamide;pyrrolidine
PubChem CID19102236
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC NameN-phenylformamide;pyrrolidine
SMILESC1CCNC1.O=CNc1ccccc1
InChIInChI=1S/C7H7NO.C4H9N/c9-6-8-7-4-2-1-3-5-7;1-2-4-5-3-1/h1-6H,(H,8,9);5H,1-4H2
InChIKeyNCBYXWPTVVLITQ-UHFFFAOYSA-N
XLogP1.62
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

cesium;hydride;N-phenylformamide
CID 173414611
lithium;hydride;N-phenylformamide
CID 174281873
phenylhydrazine;pyrrolidine
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phenylhydrazine;piperidine
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2-phenylacetaldehyde;pyrrolidine
CID 23356706
N-(4-cyclohexylphenyl)formamide;3-phenylpyrrolidine
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CID 87987898
N-(4-cyanophenyl)formamide;4-methylpiperidine
CID 175001445
N-methylaniline;piperazine
CID 157393585
N-(2-anilinophenyl)formamide
CID 59918917
5-methylidene-3-phenylimidazolidine-2,4-dione;N-phenylformamide
CID 21318193
3,4-dichloro-N-methylaniline;N-phenylformamide
CID 178016715

Frequently Asked Questions

What is the IUPAC name of N-phenylformamide;pyrrolidine?
The IUPAC name of N-phenylformamide;pyrrolidine (CID 19102236) is N-phenylformamide;pyrrolidine.
What is the SMILES notation for N-phenylformamide;pyrrolidine?
The canonical SMILES for N-phenylformamide;pyrrolidine is C1CCNC1.O=CNc1ccccc1.
What is the InChIKey of N-phenylformamide;pyrrolidine?
The InChIKey is NCBYXWPTVVLITQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7NO.C4H9N/c9-6-8-7-4-2-1-3-5-7;1-2-4-5-3-1/h1-6H,(H,8,9);5H,1-4H2.
What are the key properties of N-phenylformamide;pyrrolidine?
N-phenylformamide;pyrrolidine has a molecular weight of 192.26 g/mol, XLogP of 1.62, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenylformamide;pyrrolidine is sourced from PubChem (CID 19102236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).