N-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide

C18H24N2O3 — CID 71932136

IUPACN-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide
SMILESO=C(COc1ccc(C(=O)N2CCCC2)cc1)NCC1CCC1
InChIInChI=1S/C18H24N2O3/c21-17(19-12-14-4-3-5-14)13-23-16-8-6-15(7-9-16)18(22)20-10-1-2-11-20/h6-9,14H,1-5,10-13H2,(H,19,21)
InChIKeyDPQZOGIIDFGDLN-UHFFFAOYSA-N
MW316.40 g/mol
LogP2.22
Rot. Bonds6

About N-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide

N-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide (PubChem CID 71932136) has the molecular formula C18H24N2O3 and a molecular weight of 316.40 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide
PubChem CID71932136
Molecular FormulaC18H24N2O3
Molecular Weight316.40 g/mol
Exact Mass316.18
IUPAC NameN-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide
SMILESO=C(COc1ccc(C(=O)N2CCCC2)cc1)NCC1CCC1
InChIInChI=1S/C18H24N2O3/c21-17(19-12-14-4-3-5-14)13-23-16-8-6-15(7-9-16)18(22)20-10-1-2-11-20/h6-9,14H,1-5,10-13H2,(H,19,21)
InChIKeyDPQZOGIIDFGDLN-UHFFFAOYSA-N
XLogP2.22
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromophenoxy)-N-(cyclobutylmethyl)acetamide
CID 94168869
2-[4-[3-(acetamidomethyl)piperidine-1-carbonyl]phenoxy]acetic acid
CID 136552189
N-(cyclohexylmethyl)-2-(4-propanoylphenoxy)acetamide
CID 78760578
2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide
CID 90521344
[2-(cyclohexylmethylamino)-2-oxoethyl] 1-(4-chlorobenzoyl)piperidine-4-carboxylate
CID 8635167
2-[4-(aminomethyl)phenoxy]-N-(cyclopentylmethyl)acetamide
CID 43370712
2-(4-benzoylphenoxy)-N-(cyclopropylmethyl)acetamide
CID 134038104
N-[(1-acetylpiperidin-4-yl)methyl]-2-(4-methylphenoxy)acetamide
CID 110736170
N-[[1-(3,4-dimethoxybenzoyl)piperidin-4-yl]methyl]-2-(3,4-dimethylphenoxy)acetamide
CID 108935291
N-(cyclopropylmethyl)-4-(4-methoxybenzoyl)-1,4-diazepane-1-carboxamide
CID 23938280
4-[2-oxo-2-(piperidin-3-ylmethylamino)ethoxy]benzamide
CID 119462303
N-[[(3R)-1-(4-methoxybenzoyl)piperidin-3-yl]methyl]butanamide
CID 95295388

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide?
The IUPAC name of N-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide (CID 71932136) is N-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide.
What is the SMILES notation for N-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide?
The canonical SMILES for N-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide is O=C(COc1ccc(C(=O)N2CCCC2)cc1)NCC1CCC1.
What is the InChIKey of N-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide?
The InChIKey is DPQZOGIIDFGDLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O3/c21-17(19-12-14-4-3-5-14)13-23-16-8-6-15(7-9-16)18(22)20-10-1-2-11-20/h6-9,14H,1-5,10-13H2,(H,19,21).
What are the key properties of N-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide?
N-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide has a molecular weight of 316.40 g/mol, XLogP of 2.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-2-[4-(pyrrolidine-1-carbonyl)phenoxy]acetamide is sourced from PubChem (CID 71932136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).