1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide

C16H21N3O2 — CID 944689

IUPAC1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C[C@H](O)c2c[nH]c3ccccc23)CC1
InChIInChI=1S/C16H21N3O2/c17-16(21)11-5-7-19(8-6-11)10-15(20)13-9-18-14-4-2-1-3-12(13)14/h1-4,9,11,15,18,20H,5-8,10H2,(H2,17,21)/t15-/m0/s1
InChIKeyBTACRCWROWYHQZ-HNNXBMFYSA-N
MW287.36 g/mol
LogP1.40
Rot. Bonds4

About 1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide

1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide (PubChem CID 944689) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide
PubChem CID944689
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C[C@H](O)c2c[nH]c3ccccc23)CC1
InChIInChI=1S/C16H21N3O2/c17-16(21)11-5-7-19(8-6-11)10-15(20)13-9-18-14-4-2-1-3-12(13)14/h1-4,9,11,15,18,20H,5-8,10H2,(H2,17,21)/t15-/m0/s1
InChIKeyBTACRCWROWYHQZ-HNNXBMFYSA-N
XLogP1.40
TPSA82.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2R)-2-hydroxy-2-phenylethyl]piperidine-4-carboxamide
CID 718707
2-[4-(4-fluorophenyl)piperazin-1-yl]-1-(1H-indol-3-yl)ethanol
CID 3806013
(1R)-2-[4-(2-fluorophenyl)piperazin-1-yl]-1-(1H-indol-3-yl)ethanol
CID 919244
(1R)-1-(1H-indol-3-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]ethanol
CID 2003978
1-[3-(1H-indol-3-yl)propanoyl]piperidine-4-carboxamide
CID 17408046
3-amino-1-(1H-indol-3-yl)propan-1-ol
CID 82281300
benzyl 3-amino-3-(1H-indol-3-yl)-2-(piperidin-1-ylmethyl)propanoate
CID 173217960
1-[2-(1H-indol-3-yl)-2-oxoethyl]piperidine-3-carboxamide
CID 43226754
1-[2-hydroxy-3-(1H-indol-3-yl)propanoyl]pyrrolidine-2-carboxamide
CID 70941046
[1-[3-(1H-indol-3-yl)-3-phenylpropyl]piperidin-4-yl]-phenylmethanol
CID 58088658
1-[(2S)-2-hydroxy-2-(3-nitrophenyl)ethyl]piperidine-4-carboxamide
CID 34364427
1-[2-(1H-indol-3-yl)acetyl]piperidine-3-carboxamide
CID 43397905

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide?
The IUPAC name of 1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide (CID 944689) is 1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide is NC(=O)C1CCN(C[C@H](O)c2c[nH]c3ccccc23)CC1.
What is the InChIKey of 1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide?
The InChIKey is BTACRCWROWYHQZ-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H21N3O2/c17-16(21)11-5-7-19(8-6-11)10-15(20)13-9-18-14-4-2-1-3-12(13)14/h1-4,9,11,15,18,20H,5-8,10H2,(H2,17,21)/t15-/m0/s1.
What are the key properties of 1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide?
1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide has a molecular weight of 287.36 g/mol, XLogP of 1.40, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-hydroxy-2-(1H-indol-3-yl)ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 944689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).