N-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide

C16H20N2O2 — CID 111444945

IUPACN-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide
SMILESCc1ccc2c(CC(=O)NCC3(O)CCC3)c[nH]c2c1
InChIInChI=1S/C16H20N2O2/c1-11-3-4-13-12(9-17-14(13)7-11)8-15(19)18-10-16(20)5-2-6-16/h3-4,7,9,17,20H,2,5-6,8,10H2,1H3,(H,18,19)
InChIKeyWHOZXPVSAOYACW-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.05
Rot. Bonds4

About N-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide

N-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide (PubChem CID 111444945) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide
PubChem CID111444945
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide
SMILESCc1ccc2c(CC(=O)NCC3(O)CCC3)c[nH]c2c1
InChIInChI=1S/C16H20N2O2/c1-11-3-4-13-12(9-17-14(13)7-11)8-15(19)18-10-16(20)5-2-6-16/h3-4,7,9,17,20H,2,5-6,8,10H2,1H3,(H,18,19)
InChIKeyWHOZXPVSAOYACW-UHFFFAOYSA-N
XLogP2.05
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-hydroxycyclohexyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide
CID 111459680
methyl 2-(6-methyl-1H-indol-3-yl)acetate
CID 58828790
N-[(1-hydroxycyclobutyl)methyl]-2,4-dimethylbenzamide
CID 111445481
N-[(3-hydroxythiolan-3-yl)methyl]-3-(5-methyl-1H-indol-3-yl)propanamide
CID 111596973
azane;2-(6-methyl-1H-indol-3-yl)acetamide;2-(6-methyl-1H-indol-3-yl)acetic acid;hydrate
CID 160800096
N-[(1-hydroxycyclobutyl)methyl]-2-(4-hydroxyphenyl)acetamide
CID 115696780
1-[[2-(dimethylamino)-4-methylphenyl]methyl]-3-[(1-hydroxycyclobutyl)methyl]urea
CID 111976814
N-[[1-(2-methoxyethyl)piperidin-4-yl]methyl]-2-(6-methyl-1H-indol-3-yl)acetamide
CID 71879976
N-[2-(azepan-1-yl)ethyl]-2-[6-(4-methylphenyl)-1H-indol-3-yl]acetamide
CID 90754095
N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]-2-(4-methylphenyl)acetamide
CID 65119553
N-methyl-1-(6-methyl-1H-indol-3-yl)methanamine
CID 68579797
2-[[2-(5-methyl-1H-indol-3-yl)acetyl]amino]acetic acid
CID 110835976

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide?
The IUPAC name of N-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide (CID 111444945) is N-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide.
What is the SMILES notation for N-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide?
The canonical SMILES for N-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide is Cc1ccc2c(CC(=O)NCC3(O)CCC3)c[nH]c2c1.
What is the InChIKey of N-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide?
The InChIKey is WHOZXPVSAOYACW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-11-3-4-13-12(9-17-14(13)7-11)8-15(19)18-10-16(20)5-2-6-16/h3-4,7,9,17,20H,2,5-6,8,10H2,1H3,(H,18,19).
What are the key properties of N-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide?
N-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide has a molecular weight of 272.35 g/mol, XLogP of 2.05, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclobutyl)methyl]-2-(6-methyl-1H-indol-3-yl)acetamide is sourced from PubChem (CID 111444945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).