N-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide

C18H27N3O — CID 145399732

IUPACN-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide
SMILESCC(=O)NC(CCCc1ccc2[nH]ccc2c1)CCN(C)C
InChIInChI=1S/C18H27N3O/c1-14(22)20-17(10-12-21(2)3)6-4-5-15-7-8-18-16(13-15)9-11-19-18/h7-9,11,13,17,19H,4-6,10,12H2,1-3H3,(H,20,22)
InChIKeyUAOZTAZRGCZWLF-UHFFFAOYSA-N
MW301.43 g/mol
LogP2.95
Rot. Bonds8

About N-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide

N-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide (PubChem CID 145399732) has the molecular formula C18H27N3O and a molecular weight of 301.43 g/mol. Its IUPAC name is N-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide.

Molecular Properties

Compound NameN-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide
PubChem CID145399732
Molecular FormulaC18H27N3O
Molecular Weight301.43 g/mol
Exact Mass301.22
IUPAC NameN-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide
SMILESCC(=O)NC(CCCc1ccc2[nH]ccc2c1)CCN(C)C
InChIInChI=1S/C18H27N3O/c1-14(22)20-17(10-12-21(2)3)6-4-5-15-7-8-18-16(13-15)9-11-19-18/h7-9,11,13,17,19H,4-6,10,12H2,1-3H3,(H,20,22)
InChIKeyUAOZTAZRGCZWLF-UHFFFAOYSA-N
XLogP2.95
TPSA48.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.43
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide?
The IUPAC name of N-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide (CID 145399732) is N-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide.
What is the SMILES notation for N-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide?
The canonical SMILES for N-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide is CC(=O)NC(CCCc1ccc2[nH]ccc2c1)CCN(C)C.
What is the InChIKey of N-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide?
The InChIKey is UAOZTAZRGCZWLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O/c1-14(22)20-17(10-12-21(2)3)6-4-5-15-7-8-18-16(13-15)9-11-19-18/h7-9,11,13,17,19H,4-6,10,12H2,1-3H3,(H,20,22).
What are the key properties of N-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide?
N-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide has a molecular weight of 301.43 g/mol, XLogP of 2.95, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(dimethylamino)-6-(1H-indol-5-yl)hexan-3-yl]acetamide is sourced from PubChem (CID 145399732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).