N-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide

C18H20N2O — CID 28569421

IUPACN-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide
SMILESO=C(CNc1ccccc1-c1ccccc1)NCC1CC1
InChIInChI=1S/C18H20N2O/c21-18(20-12-14-10-11-14)13-19-17-9-5-4-8-16(17)15-6-2-1-3-7-15/h1-9,14,19H,10-13H2,(H,20,21)
InChIKeyHGXKTQHZPHJEOB-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.29
Rot. Bonds6

About N-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide

N-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide (PubChem CID 28569421) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide
PubChem CID28569421
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC NameN-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide
SMILESO=C(CNc1ccccc1-c1ccccc1)NCC1CC1
InChIInChI=1S/C18H20N2O/c21-18(20-12-14-10-11-14)13-19-17-9-5-4-8-16(17)15-6-2-1-3-7-15/h1-9,14,19H,10-13H2,(H,20,21)
InChIKeyHGXKTQHZPHJEOB-UHFFFAOYSA-N
XLogP3.29
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide (CID 28569421) is N-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide is O=C(CNc1ccccc1-c1ccccc1)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide?
The InChIKey is HGXKTQHZPHJEOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c21-18(20-12-14-10-11-14)13-19-17-9-5-4-8-16(17)15-6-2-1-3-7-15/h1-9,14,19H,10-13H2,(H,20,21).
What are the key properties of N-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide?
N-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide has a molecular weight of 280.37 g/mol, XLogP of 3.29, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-(2-phenylanilino)acetamide is sourced from PubChem (CID 28569421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).