N-(4-propoxyanilino)formamide

C10H14N2O2 — CID 70440281

IUPACN-(4-propoxyanilino)formamide
SMILESCCCOc1ccc(NNC=O)cc1
InChIInChI=1S/C10H14N2O2/c1-2-7-14-10-5-3-9(4-6-10)12-11-8-13/h3-6,8,12H,2,7H2,1H3,(H,11,13)
InChIKeyOCWYJOGIPLSRTA-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.55
Rot. Bonds6

About N-(4-propoxyanilino)formamide

N-(4-propoxyanilino)formamide (PubChem CID 70440281) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is N-(4-propoxyanilino)formamide.

Molecular Properties

Compound NameN-(4-propoxyanilino)formamide
PubChem CID70440281
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC NameN-(4-propoxyanilino)formamide
SMILESCCCOc1ccc(NNC=O)cc1
InChIInChI=1S/C10H14N2O2/c1-2-7-14-10-5-3-9(4-6-10)12-11-8-13/h3-6,8,12H,2,7H2,1H3,(H,11,13)
InChIKeyOCWYJOGIPLSRTA-UHFFFAOYSA-N
XLogP1.55
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-N',2-N'-bis(4-propoxyphenyl)ethanedihydrazide
CID 138619746
N-(4-propoxyphenyl)ethanesulfonamide
CID 50895245
1-octyl-2-(4-propoxyphenyl)hydrazine
CID 70349375
N-[4-[5-[(4-butoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]anilino]formamide
CID 163830020
N-propan-2-yl-4-propoxyaniline
CID 21311809
1-(4-butoxyphenyl)-2-(4-ethylphenyl)hydrazine
CID 177145678
2-[(4-propoxyanilino)methylidene]propanedioic acid
CID 18784127
2-(4-propoxyanilino)acetic acid
CID 15310375
1-ethyl-3-(4-propoxyphenyl)urea
CID 115881886
N-butan-2-yl-4-propoxyaniline
CID 21311789
(E)-4-(4-propoxyanilino)but-2-enoic acid
CID 103248230
N-ethyl-N'-(4-propoxyphenyl)oxamide
CID 124624762

Frequently Asked Questions

What is the IUPAC name of N-(4-propoxyanilino)formamide?
The IUPAC name of N-(4-propoxyanilino)formamide (CID 70440281) is N-(4-propoxyanilino)formamide.
What is the SMILES notation for N-(4-propoxyanilino)formamide?
The canonical SMILES for N-(4-propoxyanilino)formamide is CCCOc1ccc(NNC=O)cc1.
What is the InChIKey of N-(4-propoxyanilino)formamide?
The InChIKey is OCWYJOGIPLSRTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-2-7-14-10-5-3-9(4-6-10)12-11-8-13/h3-6,8,12H,2,7H2,1H3,(H,11,13).
What are the key properties of N-(4-propoxyanilino)formamide?
N-(4-propoxyanilino)formamide has a molecular weight of 194.23 g/mol, XLogP of 1.55, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propoxyanilino)formamide is sourced from PubChem (CID 70440281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).