4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide

C16H24N2O3 — CID 155188921

IUPAC4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide
SMILESCC(C)c1ccc(COCC(CCC(N)=O)NC=O)cc1
InChIInChI=1S/C16H24N2O3/c1-12(2)14-5-3-13(4-6-14)9-21-10-15(18-11-19)7-8-16(17)20/h3-6,11-12,15H,7-10H2,1-2H3,(H2,17,20)(H,18,19)
InChIKeyIAADNAIUYJXOAQ-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.71
Rot. Bonds10

About 4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide

4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide (PubChem CID 155188921) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide.

Molecular Properties

Compound Name4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide
PubChem CID155188921
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide
SMILESCC(C)c1ccc(COCC(CCC(N)=O)NC=O)cc1
InChIInChI=1S/C16H24N2O3/c1-12(2)14-5-3-13(4-6-14)9-21-10-15(18-11-19)7-8-16(17)20/h3-6,11-12,15H,7-10H2,1-2H3,(H2,17,20)(H,18,19)
InChIKeyIAADNAIUYJXOAQ-UHFFFAOYSA-N
XLogP1.71
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

(4S,5R)-4-formamido-5-[(4-methylphenyl)methoxy]hexanamide
CID 170200819
4-[(4-propan-2-ylphenyl)methylamino]butanamide
CID 60863561
ethane;3-(4-propan-2-ylphenyl)propanamide
CID 142410323
N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide
CID 116846698
(4-propan-2-ylphenyl)methyl 2-methylpropanoate
CID 58781802
6-[3-[(2S)-5-amino-2-formamido-5-oxopentoxy]-5-chlorophenyl]hexanamide
CID 170208907
(4S)-4-amino-5-phenylmethoxypentanamide
CID 90463454
6-[3-(5-amino-2-formamido-5-oxopentoxy)-6-fluoro-2-methylphenyl]hexanamide
CID 155707244
6-[3-[(2S)-5-amino-2-formamido-5-oxopentoxy]-2-fluoro-6-methylphenyl]hexanamide
CID 170207701
2-[2-(4-propan-2-ylphenyl)ethylamino]acetamide
CID 115260058
[(2R)-2-[[(1S)-1-phenylethyl]amino]-3-phenylmethoxypropyl] acetate
CID 11110232
4-[[(4-propan-2-ylphenyl)methylamino]methyl]benzamide
CID 60658050

Frequently Asked Questions

What is the IUPAC name of 4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide?
The IUPAC name of 4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide (CID 155188921) is 4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide.
What is the SMILES notation for 4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide?
The canonical SMILES for 4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide is CC(C)c1ccc(COCC(CCC(N)=O)NC=O)cc1.
What is the InChIKey of 4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide?
The InChIKey is IAADNAIUYJXOAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-12(2)14-5-3-13(4-6-14)9-21-10-15(18-11-19)7-8-16(17)20/h3-6,11-12,15H,7-10H2,1-2H3,(H2,17,20)(H,18,19).
What are the key properties of 4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide?
4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide has a molecular weight of 292.38 g/mol, XLogP of 1.71, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-formamido-5-[(4-propan-2-ylphenyl)methoxy]pentanamide is sourced from PubChem (CID 155188921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).