4-(1-propylindol-3-yl)cyclohexane-1-carboxamide

C18H24N2O — CID 84613190

IUPAC4-(1-propylindol-3-yl)cyclohexane-1-carboxamide
SMILESCCCn1cc(C2CCC(C(N)=O)CC2)c2ccccc21
InChIInChI=1S/C18H24N2O/c1-2-11-20-12-16(15-5-3-4-6-17(15)20)13-7-9-14(10-8-13)18(19)21/h3-6,12-14H,2,7-11H2,1H3,(H2,19,21)
InChIKeyQKIVBDBTOCFTAB-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.81
Rot. Bonds4

About 4-(1-propylindol-3-yl)cyclohexane-1-carboxamide

4-(1-propylindol-3-yl)cyclohexane-1-carboxamide (PubChem CID 84613190) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 4-(1-propylindol-3-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-(1-propylindol-3-yl)cyclohexane-1-carboxamide
PubChem CID84613190
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name4-(1-propylindol-3-yl)cyclohexane-1-carboxamide
SMILESCCCn1cc(C2CCC(C(N)=O)CC2)c2ccccc21
InChIInChI=1S/C18H24N2O/c1-2-11-20-12-16(15-5-3-4-6-17(15)20)13-7-9-14(10-8-13)18(19)21/h3-6,12-14H,2,7-11H2,1H3,(H2,19,21)
InChIKeyQKIVBDBTOCFTAB-UHFFFAOYSA-N
XLogP3.81
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-aminoethyl)-4-(1-propylindol-3-yl)cyclohexane-1-carboxamide
CID 84613189
[4-(1-propylindol-3-yl)piperidin-1-yl]-(2,4,6-trichlorophenyl)methanone
CID 46090085
N-(3-aminopropyl)-4-(1-methylindol-3-yl)cyclohexane-1-carboxamide
CID 84613024
ethyl 4-[1-(2-pyridin-2-ylethyl)indol-3-yl]piperidine-1-carboxylate
CID 69415426
2-[4-[1-(3-methylbutyl)indol-3-yl]piperidin-1-yl]benzoic acid
CID 141032395
1-[1-(2-methoxyethyl)indole-3-carbonyl]pyrrolidine-3-carboxamide
CID 56819723
(E)-3-[4-[2-[4-(1-pentylindol-3-yl)piperidin-1-yl]ethyl]phenyl]prop-2-enoic acid
CID 23444897
1-[4-[1-(2-ethoxyethyl)indol-3-yl]piperidin-1-yl]-3-phenylpropan-1-one
CID 24720536
ethyl 4-[1-[(5-chlorothiophen-2-yl)methyl]indol-3-yl]piperidine-1-carboxylate
CID 11327120
1-phenyl-3-(1-propylindol-3-yl)pyrrolidine-2,5-dione
CID 23605678
3-(1-hexylpiperidin-4-yl)indol-1-amine
CID 23215958
4-[(1-propylpyrrol-2-yl)methylamino]cyclohexane-1-carboxamide
CID 66412930

Frequently Asked Questions

What is the IUPAC name of 4-(1-propylindol-3-yl)cyclohexane-1-carboxamide?
The IUPAC name of 4-(1-propylindol-3-yl)cyclohexane-1-carboxamide (CID 84613190) is 4-(1-propylindol-3-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 4-(1-propylindol-3-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 4-(1-propylindol-3-yl)cyclohexane-1-carboxamide is CCCn1cc(C2CCC(C(N)=O)CC2)c2ccccc21.
What is the InChIKey of 4-(1-propylindol-3-yl)cyclohexane-1-carboxamide?
The InChIKey is QKIVBDBTOCFTAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-2-11-20-12-16(15-5-3-4-6-17(15)20)13-7-9-14(10-8-13)18(19)21/h3-6,12-14H,2,7-11H2,1H3,(H2,19,21).
What are the key properties of 4-(1-propylindol-3-yl)cyclohexane-1-carboxamide?
4-(1-propylindol-3-yl)cyclohexane-1-carboxamide has a molecular weight of 284.40 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-propylindol-3-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 84613190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).