2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide

C11H16N2O — CID 106385129

IUPAC2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide
SMILESO=C(CC1CCC1)NCc1cc[nH]c1
InChIInChI=1S/C11H16N2O/c14-11(6-9-2-1-3-9)13-8-10-4-5-12-7-10/h4-5,7,9,12H,1-3,6,8H2,(H,13,14)
InChIKeyMYOODFLWPROBFG-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.82
Rot. Bonds4

About 2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide

2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide (PubChem CID 106385129) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide
PubChem CID106385129
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide
SMILESO=C(CC1CCC1)NCc1cc[nH]c1
InChIInChI=1S/C11H16N2O/c14-11(6-9-2-1-3-9)13-8-10-4-5-12-7-10/h4-5,7,9,12H,1-3,6,8H2,(H,13,14)
InChIKeyMYOODFLWPROBFG-UHFFFAOYSA-N
XLogP1.82
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-piperidin-3-yl-N-(1H-pyrrol-3-ylmethyl)acetamide
CID 106384935
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-(1H-pyrrol-3-ylmethyl)acetamide
CID 114181942
2-cyclopent-2-en-1-yl-N-(1H-pyrrol-3-ylmethyl)acetamide
CID 106385742
2-(cyclopentylamino)-N-(1H-pyrrol-3-ylmethyl)acetamide
CID 106384695
2-(cyclopropylamino)-N-(1H-pyrrol-3-ylmethyl)acetamide
CID 106384770
4-[[(2-cyclobutylacetyl)amino]methyl]benzoic acid
CID 113265035
N-(1H-pyrrol-3-ylmethyl)cycloheptanecarboxamide
CID 106385859
N-(cyclopropylmethyl)-2-(1H-pyrrol-3-ylmethylamino)acetamide
CID 115968377
2-cyclobutyl-N-[[3-(hydroxymethyl)phenyl]methyl]acetamide
CID 103710693
2-cyclobutyl-N-[(3-hydroxyphenyl)methyl]acetamide
CID 103707492
N-(1H-pyrrol-3-ylmethyl)but-3-ynamide
CID 106385791
N-[[4-(bromomethyl)phenyl]methyl]-2-cycloheptylacetamide
CID 107233781

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide?
The IUPAC name of 2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide (CID 106385129) is 2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide.
What is the SMILES notation for 2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide?
The canonical SMILES for 2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide is O=C(CC1CCC1)NCc1cc[nH]c1.
What is the InChIKey of 2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide?
The InChIKey is MYOODFLWPROBFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c14-11(6-9-2-1-3-9)13-8-10-4-5-12-7-10/h4-5,7,9,12H,1-3,6,8H2,(H,13,14).
What are the key properties of 2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide?
2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide has a molecular weight of 192.26 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-N-(1H-pyrrol-3-ylmethyl)acetamide is sourced from PubChem (CID 106385129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).