1H-indol-5-yl piperidine-1-carboxylate

C14H16N2O2 — CID 175932664

IUPAC1H-indol-5-yl piperidine-1-carboxylate
SMILESO=C(Oc1ccc2[nH]ccc2c1)N1CCCCC1
InChIInChI=1S/C14H16N2O2/c17-14(16-8-2-1-3-9-16)18-12-4-5-13-11(10-12)6-7-15-13/h4-7,10,15H,1-3,8-9H2
InChIKeyUYYUQHDSHHFUEC-UHFFFAOYSA-N
MW244.29 g/mol
LogP3.15
Rot. Bonds1

About 1H-indol-5-yl piperidine-1-carboxylate

1H-indol-5-yl piperidine-1-carboxylate (PubChem CID 175932664) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 1H-indol-5-yl piperidine-1-carboxylate.

Molecular Properties

Compound Name1H-indol-5-yl piperidine-1-carboxylate
PubChem CID175932664
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name1H-indol-5-yl piperidine-1-carboxylate
SMILESO=C(Oc1ccc2[nH]ccc2c1)N1CCCCC1
InChIInChI=1S/C14H16N2O2/c17-14(16-8-2-1-3-9-16)18-12-4-5-13-11(10-12)6-7-15-13/h4-7,10,15H,1-3,8-9H2
InChIKeyUYYUQHDSHHFUEC-UHFFFAOYSA-N
XLogP3.15
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-fluorophenyl) piperidine-1-carboxylate
CID 895621
(2-methylquinolin-6-yl) pyrrolidine-1-carboxylate
CID 59825519
[8-(piperidine-1-carbonyloxy)naphthalen-2-yl] piperidine-1-carboxylate
CID 23766816
4-(1H-indol-5-yloxy)benzoic acid
CID 129206286
(4-formyl-3-hydroxyphenyl) piperidine-1-carboxylate
CID 118041589
5-propan-2-yloxy-1H-indole
CID 16738054
5-cycloheptyloxy-1H-indole
CID 82923976
cyclohexane;5-methoxy-1H-indole;N-methylcyclopentanecarboxamide
CID 145244108
1H-indol-5-yl pentanoate
CID 174735386
1H-indol-6-yl hydrogen carbonate
CID 57316242
(4-fluoro-1H-pyrrolo[2,3-c]pyridin-5-yl) piperidine-1-carboxylate
CID 175772814
[3-(1H-indol-5-yl)-1,2,4-oxadiazol-5-yl]-piperidin-1-ylmethanone
CID 42568916

Frequently Asked Questions

What is the IUPAC name of 1H-indol-5-yl piperidine-1-carboxylate?
The IUPAC name of 1H-indol-5-yl piperidine-1-carboxylate (CID 175932664) is 1H-indol-5-yl piperidine-1-carboxylate.
What is the SMILES notation for 1H-indol-5-yl piperidine-1-carboxylate?
The canonical SMILES for 1H-indol-5-yl piperidine-1-carboxylate is O=C(Oc1ccc2[nH]ccc2c1)N1CCCCC1.
What is the InChIKey of 1H-indol-5-yl piperidine-1-carboxylate?
The InChIKey is UYYUQHDSHHFUEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c17-14(16-8-2-1-3-9-16)18-12-4-5-13-11(10-12)6-7-15-13/h4-7,10,15H,1-3,8-9H2.
What are the key properties of 1H-indol-5-yl piperidine-1-carboxylate?
1H-indol-5-yl piperidine-1-carboxylate has a molecular weight of 244.29 g/mol, XLogP of 3.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-indol-5-yl piperidine-1-carboxylate is sourced from PubChem (CID 175932664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).