N-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide

C18H24N2O2 — CID 111536296

IUPACN-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide
SMILESCc1ccc2[nH]cc(CCC(=O)NC3CCC(O)CC3)c2c1
InChIInChI=1S/C18H24N2O2/c1-12-2-8-17-16(10-12)13(11-19-17)3-9-18(22)20-14-4-6-15(21)7-5-14/h2,8,10-11,14-15,19,21H,3-7,9H2,1H3,(H,20,22)
InChIKeyWYIGDLSZKRUMHJ-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.83
Rot. Bonds4

About N-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide

N-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide (PubChem CID 111536296) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is N-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide.

Molecular Properties

Compound NameN-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide
PubChem CID111536296
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC NameN-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide
SMILESCc1ccc2[nH]cc(CCC(=O)NC3CCC(O)CC3)c2c1
InChIInChI=1S/C18H24N2O2/c1-12-2-8-17-16(10-12)13(11-19-17)3-9-18(22)20-14-4-6-15(21)7-5-14/h2,8,10-11,14-15,19,21H,3-7,9H2,1H3,(H,20,22)
InChIKeyWYIGDLSZKRUMHJ-UHFFFAOYSA-N
XLogP2.83
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-4-(1H-indol-3-yl)butanamide
CID 729220
1-[2-(5-fluoro-1H-indol-3-yl)ethyl]-3-(4-hydroxycyclohexyl)urea
CID 111423653
3-(5-methyl-1H-indol-3-yl)-N-(4-methylsulfanylbutyl)propanamide
CID 71925432
3-(5-methyl-1H-indol-3-yl)-N-[(2S)-pent-4-en-2-yl]propanamide
CID 95930494
2-(4-hydroxypiperidin-1-yl)-N-[2-(5-methyl-1H-indol-3-yl)ethyl]propanamide
CID 167780744
2-chloro-N-[2-(5-methyl-1H-indol-3-yl)ethyl]acetamide
CID 17339304
N-[(3-hydroxythiolan-3-yl)methyl]-3-(5-methyl-1H-indol-3-yl)propanamide
CID 111596973
N-[1-(1-cyclopropylethyl)pyrazol-4-yl]-3-(5-methyl-1H-indol-3-yl)propanamide
CID 126779213
N-(4-hydroxycyclohexyl)-3-(2-hydroxyphenyl)propanamide
CID 43394595
(2R)-N-[2-(5-methyl-1H-indol-3-yl)ethyl]oxolane-2-carboxamide
CID 7248046
N-cyclopropyl-4-[[ethylamino-[2-(6-methyl-1H-indol-3-yl)ethylamino]methylidene]amino]butanamide
CID 111974360
N-(4-aminocyclohexyl)-3-(2,4-dimethylphenyl)propanamide;hydrochloride
CID 119475057

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide?
The IUPAC name of N-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide (CID 111536296) is N-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide.
What is the SMILES notation for N-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide?
The canonical SMILES for N-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide is Cc1ccc2[nH]cc(CCC(=O)NC3CCC(O)CC3)c2c1.
What is the InChIKey of N-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide?
The InChIKey is WYIGDLSZKRUMHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-12-2-8-17-16(10-12)13(11-19-17)3-9-18(22)20-14-4-6-15(21)7-5-14/h2,8,10-11,14-15,19,21H,3-7,9H2,1H3,(H,20,22).
What are the key properties of N-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide?
N-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide has a molecular weight of 300.40 g/mol, XLogP of 2.83, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxycyclohexyl)-3-(5-methyl-1H-indol-3-yl)propanamide is sourced from PubChem (CID 111536296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).