N-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide

C15H21N3O2 — CID 113094101

IUPACN-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide
SMILESCC(=O)N(c1ccc(NC(=O)NC(C)C)cc1)C1CC1
InChIInChI=1S/C15H21N3O2/c1-10(2)16-15(20)17-12-4-6-13(7-5-12)18(11(3)19)14-8-9-14/h4-7,10,14H,8-9H2,1-3H3,(H2,16,17,20)
InChIKeyLDYWPKOAAYPYRI-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.73
Rot. Bonds4

About N-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide

N-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide (PubChem CID 113094101) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide
PubChem CID113094101
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide
SMILESCC(=O)N(c1ccc(NC(=O)NC(C)C)cc1)C1CC1
InChIInChI=1S/C15H21N3O2/c1-10(2)16-15(20)17-12-4-6-13(7-5-12)18(11(3)19)14-8-9-14/h4-7,10,14H,8-9H2,1-3H3,(H2,16,17,20)
InChIKeyLDYWPKOAAYPYRI-UHFFFAOYSA-N
XLogP2.73
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[acetyl(cyclopropyl)amino]phenyl]-2,2-dimethylpropanamide
CID 113094036
N-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide
CID 113094031
N-(oxan-4-yl)-N-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 113094206
N-[4-[oxan-4-yl(propan-2-ylcarbamoyl)amino]phenyl]acetamide
CID 113095241
N-[4-(cyclopropylcarbamoylamino)phenyl]-N-(oxan-4-yl)acetamide
CID 113094214
methyl N-(4-acetamidophenyl)-N-cyclopropylcarbamate
CID 113095123
N-[4-[acetyl(cyclopropyl)amino]phenyl]-4-chlorobenzamide
CID 113094075
1-[4-[methylsulfonyl(oxan-4-yl)amino]phenyl]-3-propan-2-ylurea
CID 113094462
N-[4-[acetyl(cyclopropyl)amino]phenyl]-2-bromobenzamide
CID 113094047
1-[4-(dipropylamino)phenyl]-3-propan-2-ylurea
CID 112985654
N-(4-acetamidophenyl)-N-cyclopropyl-2-ethylbutanamide
CID 113095067
N-[4-[acetyl(cyclopropyl)amino]phenyl]-3-bromobenzamide
CID 113094048

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide?
The IUPAC name of N-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide (CID 113094101) is N-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide.
What is the SMILES notation for N-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide?
The canonical SMILES for N-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide is CC(=O)N(c1ccc(NC(=O)NC(C)C)cc1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide?
The InChIKey is LDYWPKOAAYPYRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-10(2)16-15(20)17-12-4-6-13(7-5-12)18(11(3)19)14-8-9-14/h4-7,10,14H,8-9H2,1-3H3,(H2,16,17,20).
What are the key properties of N-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide?
N-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide has a molecular weight of 275.35 g/mol, XLogP of 2.73, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide is sourced from PubChem (CID 113094101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).