N-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide

C16H19ClN2O — CID 157358661

IUPACN-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide
SMILESCC(=O)NC1CCC(c2cc(Cl)cc3[nH]ccc23)CC1
InChIInChI=1S/C16H19ClN2O/c1-10(20)19-13-4-2-11(3-5-13)15-8-12(17)9-16-14(15)6-7-18-16/h6-9,11,13,18H,2-5H2,1H3,(H,19,20)
InChIKeyPSLGJKKGJFOUHE-UHFFFAOYSA-N
MW290.79 g/mol
LogP3.98
Rot. Bonds2

About N-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide

N-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide (PubChem CID 157358661) has the molecular formula C16H19ClN2O and a molecular weight of 290.79 g/mol. Its IUPAC name is N-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide.

Molecular Properties

Compound NameN-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide
PubChem CID157358661
Molecular FormulaC16H19ClN2O
Molecular Weight290.79 g/mol
Exact Mass290.12
IUPAC NameN-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide
SMILESCC(=O)NC1CCC(c2cc(Cl)cc3[nH]ccc23)CC1
InChIInChI=1S/C16H19ClN2O/c1-10(20)19-13-4-2-11(3-5-13)15-8-12(17)9-16-14(15)6-7-18-16/h6-9,11,13,18H,2-5H2,1H3,(H,19,20)
InChIKeyPSLGJKKGJFOUHE-UHFFFAOYSA-N
XLogP3.98
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.79
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

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N-Demethyl-LSD
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D-Lysergic acid N,N-diethylamide
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5-Chloro-alphamt
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N-Ethylnorlysergic acid N,N-diethylamide
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Tepirindole
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Ergoline-8-carboxamide, 9,10-didehydro-N,N-diethyl-6-(2-propen-1-yl)-, (8beta)-
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(3H)Lsd
CID 44559100
r-2-Pentyl lysergamide
CID 10427207

Frequently Asked Questions

What is the IUPAC name of N-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide?
The IUPAC name of N-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide (CID 157358661) is N-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide.
What is the SMILES notation for N-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide?
The canonical SMILES for N-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide is CC(=O)NC1CCC(c2cc(Cl)cc3[nH]ccc23)CC1.
What is the InChIKey of N-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide?
The InChIKey is PSLGJKKGJFOUHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN2O/c1-10(20)19-13-4-2-11(3-5-13)15-8-12(17)9-16-14(15)6-7-18-16/h6-9,11,13,18H,2-5H2,1H3,(H,19,20).
What are the key properties of N-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide?
N-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide has a molecular weight of 290.79 g/mol, XLogP of 3.98, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(6-chloro-1H-indol-4-yl)cyclohexyl]acetamide is sourced from PubChem (CID 157358661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).