N-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide

C15H18N2O2 — CID 113094031

IUPACN-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide
SMILESCC(=O)N(c1ccc(NC(=O)C2CC2)cc1)C1CC1
InChIInChI=1S/C15H18N2O2/c1-10(18)17(14-8-9-14)13-6-4-12(5-7-13)16-15(19)11-2-3-11/h4-7,11,14H,2-3,8-9H2,1H3,(H,16,19)
InChIKeyKWSWKUFFRJJWNC-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.55
Rot. Bonds4

About N-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide

N-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide (PubChem CID 113094031) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide
PubChem CID113094031
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide
SMILESCC(=O)N(c1ccc(NC(=O)C2CC2)cc1)C1CC1
InChIInChI=1S/C15H18N2O2/c1-10(18)17(14-8-9-14)13-6-4-12(5-7-13)16-15(19)11-2-3-11/h4-7,11,14H,2-3,8-9H2,1H3,(H,16,19)
InChIKeyKWSWKUFFRJJWNC-UHFFFAOYSA-N
XLogP2.55
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[acetyl(cyclopropyl)amino]phenyl]-2,2-dimethylpropanamide
CID 113094036
N-cyclopropyl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide
CID 113094101
N-[4-[acetyl(cyclopropyl)amino]phenyl]-4-chlorobenzamide
CID 113094075
N-[4-[acetyl(cyclopropyl)amino]phenyl]-2-bromobenzamide
CID 113094047
methyl N-(4-acetamidophenyl)-N-cyclopropylcarbamate
CID 113095123
N-[4-[acetyl(cyclopropyl)amino]phenyl]-3-bromobenzamide
CID 113094048
N-(oxan-4-yl)-N-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 113094206
N-[4-(cyclopropylcarbamoylamino)phenyl]-N-(oxan-4-yl)acetamide
CID 113094214
N-[4-(cyclopropanecarbonylamino)phenyl]cyclohexanecarboxamide
CID 25276011
N-[4-[acetyl(oxan-4-yl)amino]phenyl]butanamide
CID 113094156
4-amino-N-[4-(diethylamino)phenyl]cyclohexane-1-carboxamide
CID 60847830
N-[4-[acetyl(oxan-4-yl)amino]phenyl]-4-methylbenzamide
CID 113094170

Frequently Asked Questions

What is the IUPAC name of N-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide (CID 113094031) is N-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide is CC(=O)N(c1ccc(NC(=O)C2CC2)cc1)C1CC1.
What is the InChIKey of N-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide?
The InChIKey is KWSWKUFFRJJWNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-10(18)17(14-8-9-14)13-6-4-12(5-7-13)16-15(19)11-2-3-11/h4-7,11,14H,2-3,8-9H2,1H3,(H,16,19).
What are the key properties of N-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide?
N-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide has a molecular weight of 258.32 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[acetyl(cyclopropyl)amino]phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 113094031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).