2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide

C18H24N2O2 — CID 95784949

IUPAC2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide
SMILESCC[C@@H](NC(=O)Cn1ccc2ccccc21)C1CCOCC1
InChIInChI=1S/C18H24N2O2/c1-2-16(14-8-11-22-12-9-14)19-18(21)13-20-10-7-15-5-3-4-6-17(15)20/h3-7,10,14,16H,2,8-9,11-13H2,1H3,(H,19,21)/t16-/m1/s1
InChIKeyIDRVYOXPNPOGKJ-MRXNPFEDSA-N
MW300.40 g/mol
LogP2.96
Rot. Bonds5

About 2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide

2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide (PubChem CID 95784949) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide.

Molecular Properties

Compound Name2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide
PubChem CID95784949
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide
SMILESCC[C@@H](NC(=O)Cn1ccc2ccccc21)C1CCOCC1
InChIInChI=1S/C18H24N2O2/c1-2-16(14-8-11-22-12-9-14)19-18(21)13-20-10-7-15-5-3-4-6-17(15)20/h3-7,10,14,16H,2,8-9,11-13H2,1H3,(H,19,21)/t16-/m1/s1
InChIKeyIDRVYOXPNPOGKJ-MRXNPFEDSA-N
XLogP2.96
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-indol-1-ylacetyl)amino]butanoic acid
CID 119223861
2-indol-1-yl-N-[1-(2-methylpyrazol-3-yl)propyl]acetamide
CID 91829109
N-[(4-hydroxyoxan-4-yl)methyl]-2-indol-1-ylacetamide
CID 71989531
N-[2-(dimethylamino)ethyl]-2-indol-1-yl-N-(oxan-4-yl)acetamide
CID 90606965
N-[1-(3-hydroxycyclobutyl)-2-pyridin-2-ylethyl]-2-indol-1-ylacetamide
CID 91767745
(2R)-2-[(2-indol-1-ylacetyl)amino]-2-phenylacetic acid
CID 45491721
2-indol-1-yl-N-(oxolan-2-ylmethyl)acetamide
CID 5125884
N-[(3-hydroxycyclobutyl)-pyridin-2-ylmethyl]-2-indol-1-ylacetamide
CID 91766951
N-tert-butyl-2-indol-1-ylacetamide
CID 47348922
N'-acetyl-2-indol-1-ylacetohydrazide
CID 4587603
1-(2,6-dimethylpiperidin-1-yl)-2-indol-1-ylethanone
CID 110702430
N-(2-amino-6-methylphenyl)-2-indol-1-ylacetamide
CID 43376298

Frequently Asked Questions

What is the IUPAC name of 2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide?
The IUPAC name of 2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide (CID 95784949) is 2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide.
What is the SMILES notation for 2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide?
The canonical SMILES for 2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide is CC[C@@H](NC(=O)Cn1ccc2ccccc21)C1CCOCC1.
What is the InChIKey of 2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide?
The InChIKey is IDRVYOXPNPOGKJ-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-2-16(14-8-11-22-12-9-14)19-18(21)13-20-10-7-15-5-3-4-6-17(15)20/h3-7,10,14,16H,2,8-9,11-13H2,1H3,(H,19,21)/t16-/m1/s1.
What are the key properties of 2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide?
2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide has a molecular weight of 300.40 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-indol-1-yl-N-[(1R)-1-(oxan-4-yl)propyl]acetamide is sourced from PubChem (CID 95784949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).