N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide

C20H24N2O3 — CID 26157621

IUPACN-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide
SMILESCCCOc1cccc(C(=O)Nc2ccc(C(=O)NC(C)C)cc2)c1
InChIInChI=1S/C20H24N2O3/c1-4-12-25-18-7-5-6-16(13-18)20(24)22-17-10-8-15(9-11-17)19(23)21-14(2)3/h5-11,13-14H,4,12H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyZSLKYWRGICDELZ-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.87
Rot. Bonds7

About N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide

N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide (PubChem CID 26157621) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide.

Molecular Properties

Compound NameN-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide
PubChem CID26157621
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide
SMILESCCCOc1cccc(C(=O)Nc2ccc(C(=O)NC(C)C)cc2)c1
InChIInChI=1S/C20H24N2O3/c1-4-12-25-18-7-5-6-16(13-18)20(24)22-17-10-8-15(9-11-17)19(23)21-14(2)3/h5-11,13-14H,4,12H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyZSLKYWRGICDELZ-UHFFFAOYSA-N
XLogP3.87
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-butoxy-N-[4-(propan-2-ylcarbamoyl)phenyl]benzamide
CID 26157613
N-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide
CID 17197490
methyl 4-[(3-propoxybenzoyl)amino]benzoate
CID 2293242
3-(3-methylbutoxy)-N-(4-propoxyphenyl)benzamide
CID 4981769
N-[4-(2-phenoxyethoxy)phenyl]-3-propoxybenzamide
CID 4960126
3-propoxy-N-[4-[[4-[(3-propoxybenzoyl)amino]phenyl]methyl]phenyl]benzamide
CID 4960561
N-[4-[(3-chlorobenzoyl)amino]phenyl]-3-propoxybenzamide
CID 2289371
N-(4-anilinophenyl)-3-propoxybenzamide
CID 4960017
N-[4-(3-methoxypropylcarbamoyl)phenyl]-3-propoxybenzamide
CID 17205121
3-[(3-ethoxybenzoyl)amino]-N-propan-2-ylbenzamide
CID 17197485
3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-propan-2-ylbenzamide
CID 17197543
N-(3-oxobutan-2-yl)-3-propoxybenzamide
CID 64996689

Frequently Asked Questions

What is the IUPAC name of N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide?
The IUPAC name of N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide (CID 26157621) is N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide.
What is the SMILES notation for N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide?
The canonical SMILES for N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide is CCCOc1cccc(C(=O)Nc2ccc(C(=O)NC(C)C)cc2)c1.
What is the InChIKey of N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide?
The InChIKey is ZSLKYWRGICDELZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-4-12-25-18-7-5-6-16(13-18)20(24)22-17-10-8-15(9-11-17)19(23)21-14(2)3/h5-11,13-14H,4,12H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide?
N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide has a molecular weight of 340.42 g/mol, XLogP of 3.87, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide is sourced from PubChem (CID 26157621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).