N-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide

C15H21NO2 — CID 143930748

IUPACN-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide
SMILESCOCCc1ccc(C)c(CN(C=O)C2CC2)c1
InChIInChI=1S/C15H21NO2/c1-12-3-4-13(7-8-18-2)9-14(12)10-16(11-17)15-5-6-15/h3-4,9,11,15H,5-8,10H2,1-2H3
InChIKeyJFMSVPSBYRMJJE-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.30
Rot. Bonds7

About N-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide

N-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide (PubChem CID 143930748) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is N-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide
PubChem CID143930748
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC NameN-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide
SMILESCOCCc1ccc(C)c(CN(C=O)C2CC2)c1
InChIInChI=1S/C15H21NO2/c1-12-3-4-13(7-8-18-2)9-14(12)10-16(11-17)15-5-6-15/h3-4,9,11,15H,5-8,10H2,1-2H3
InChIKeyJFMSVPSBYRMJJE-UHFFFAOYSA-N
XLogP2.30
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide?
The IUPAC name of N-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide (CID 143930748) is N-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide.
What is the SMILES notation for N-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide?
The canonical SMILES for N-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide is COCCc1ccc(C)c(CN(C=O)C2CC2)c1.
What is the InChIKey of N-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide?
The InChIKey is JFMSVPSBYRMJJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-12-3-4-13(7-8-18-2)9-14(12)10-16(11-17)15-5-6-15/h3-4,9,11,15H,5-8,10H2,1-2H3.
What are the key properties of N-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide?
N-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide has a molecular weight of 247.34 g/mol, XLogP of 2.30, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[[5-(2-methoxyethyl)-2-methylphenyl]methyl]formamide is sourced from PubChem (CID 143930748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).