N-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide

C19H29N3O3 — CID 60569995

IUPACN-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide
SMILESCCC(NC(=O)NCCC(=O)NC1CCCC1)c1ccc(OC)cc1
InChIInChI=1S/C19H29N3O3/c1-3-17(14-8-10-16(25-2)11-9-14)22-19(24)20-13-12-18(23)21-15-6-4-5-7-15/h8-11,15,17H,3-7,12-13H2,1-2H3,(H,21,23)(H2,20,22,24)
InChIKeyBQRMPBZTLFSGOU-UHFFFAOYSA-N
MW347.46 g/mol
LogP2.89
Rot. Bonds8

About N-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide

N-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide (PubChem CID 60569995) has the molecular formula C19H29N3O3 and a molecular weight of 347.46 g/mol. Its IUPAC name is N-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide
PubChem CID60569995
Molecular FormulaC19H29N3O3
Molecular Weight347.46 g/mol
Exact Mass347.22
IUPAC NameN-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide
SMILESCCC(NC(=O)NCCC(=O)NC1CCCC1)c1ccc(OC)cc1
InChIInChI=1S/C19H29N3O3/c1-3-17(14-8-10-16(25-2)11-9-14)22-19(24)20-13-12-18(23)21-15-6-4-5-7-15/h8-11,15,17H,3-7,12-13H2,1-2H3,(H,21,23)(H2,20,22,24)
InChIKeyBQRMPBZTLFSGOU-UHFFFAOYSA-N
XLogP2.89
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.46
LogP ≤ 52.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-[1-(4-methoxyphenyl)propyl]-3-propylurea
CID 133230838
N-[3-(cyclohexylamino)-3-oxopropyl]-4-(4-methoxyphenoxy)butanamide
CID 55951561
(3R)-3-acetamido-N-cyclooctyl-3-(4-methoxyphenyl)propanamide
CID 51622723
N-cyclohexyl-3-[(5-methoxy-2-methylphenyl)carbamoylamino]propanamide
CID 72894420
1-[2-(hydroxymethyl)cyclohexyl]-3-[1-(4-methoxyphenyl)propyl]urea
CID 111630375
N-[1-(4-methoxyphenyl)propyl]cyclohexanecarboxamide
CID 18115473
N-cyclohexyl-3-[[(E)-3-(4-methoxyphenyl)prop-2-enoyl]amino]propanamide
CID 8713321
N-cyclohexyl-3-(4-methoxyphenoxy)propanamide
CID 974927
3-(cyclohexylcarbamoylamino)-N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]propanamide
CID 16620946
1-(cyclohex-3-en-1-ylmethyl)-3-[1-(4-methoxyphenyl)propyl]urea
CID 60593300
N-[3-(cyclohexylamino)-3-oxopropyl]-2-[3-(4-methoxyphenyl)prop-2-enoylamino]propanamide
CID 55951186
N-cyclohexyl-3-[[N-[(4-methoxyphenyl)methyl]-N'-methylcarbamimidoyl]amino]propanamide
CID 111183146

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide?
The IUPAC name of N-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide (CID 60569995) is N-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide.
What is the SMILES notation for N-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide?
The canonical SMILES for N-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide is CCC(NC(=O)NCCC(=O)NC1CCCC1)c1ccc(OC)cc1.
What is the InChIKey of N-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide?
The InChIKey is BQRMPBZTLFSGOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O3/c1-3-17(14-8-10-16(25-2)11-9-14)22-19(24)20-13-12-18(23)21-15-6-4-5-7-15/h8-11,15,17H,3-7,12-13H2,1-2H3,(H,21,23)(H2,20,22,24).
What are the key properties of N-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide?
N-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide has a molecular weight of 347.46 g/mol, XLogP of 2.89, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-[1-(4-methoxyphenyl)propylcarbamoylamino]propanamide is sourced from PubChem (CID 60569995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).