N-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide

C20H24N2O3 — CID 17197490

IUPACN-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide
SMILESCCCOc1cccc(C(=O)Nc2cccc(C(=O)NC(C)C)c2)c1
InChIInChI=1S/C20H24N2O3/c1-4-11-25-18-10-6-8-16(13-18)20(24)22-17-9-5-7-15(12-17)19(23)21-14(2)3/h5-10,12-14H,4,11H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyUDYZLVYVISEPTJ-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.87
Rot. Bonds7

About N-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide

N-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide (PubChem CID 17197490) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide.

Molecular Properties

Compound NameN-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide
PubChem CID17197490
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide
SMILESCCCOc1cccc(C(=O)Nc2cccc(C(=O)NC(C)C)c2)c1
InChIInChI=1S/C20H24N2O3/c1-4-11-25-18-10-6-8-16(13-18)20(24)22-17-9-5-7-15(12-17)19(23)21-14(2)3/h5-10,12-14H,4,11H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyUDYZLVYVISEPTJ-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

N-[4-(propan-2-ylcarbamoyl)phenyl]-3-propoxybenzamide
CID 26157621
3-[(3-ethoxybenzoyl)amino]-N-propan-2-ylbenzamide
CID 17197485
3-[[3-(2-ethoxyethoxy)benzoyl]amino]-N-propan-2-ylbenzamide
CID 17197543
3-(3-methylbutoxy)-N-(3-propoxyphenyl)benzamide
CID 17096779
3-(2-methylpropoxy)-N-(3-propoxyphenyl)benzamide
CID 17140377
3-[[3-(2-phenylethoxy)benzoyl]amino]-N-propan-2-ylbenzamide
CID 17197538
3-ethoxy-N-(3-propoxyphenyl)benzamide
CID 17096771
3-butoxy-N-[4-(propan-2-ylcarbamoyl)phenyl]benzamide
CID 26157613
3-propoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 26161679
3-[(3-butoxybenzoyl)amino]-N-phenylbenzamide
CID 54781128
N-(3-oxobutan-2-yl)-3-propoxybenzamide
CID 64996689
N-(4-anilinophenyl)-3-propoxybenzamide
CID 4960017

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide?
The IUPAC name of N-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide (CID 17197490) is N-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide.
What is the SMILES notation for N-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide?
The canonical SMILES for N-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide is CCCOc1cccc(C(=O)Nc2cccc(C(=O)NC(C)C)c2)c1.
What is the InChIKey of N-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide?
The InChIKey is UDYZLVYVISEPTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-4-11-25-18-10-6-8-16(13-18)20(24)22-17-9-5-7-15(12-17)19(23)21-14(2)3/h5-10,12-14H,4,11H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of N-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide?
N-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide 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-propan-2-yl-3-[(3-propoxybenzoyl)amino]benzamide is sourced from PubChem (CID 17197490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).