4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide

C19H27N3O2 — CID 111438569

IUPAC4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide
SMILESCc1ccc2c(CCNC(=O)N3CCC(C(C)O)CC3)c[nH]c2c1
InChIInChI=1S/C19H27N3O2/c1-13-3-4-17-16(12-21-18(17)11-13)5-8-20-19(24)22-9-6-15(7-10-22)14(2)23/h3-4,11-12,14-15,21,23H,5-10H2,1-2H3,(H,20,24)
InChIKeyYTGUHXNJSOKMQN-UHFFFAOYSA-N
MW329.44 g/mol
LogP2.82
Rot. Bonds4

About 4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide

4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide (PubChem CID 111438569) has the molecular formula C19H27N3O2 and a molecular weight of 329.44 g/mol. Its IUPAC name is 4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide
PubChem CID111438569
Molecular FormulaC19H27N3O2
Molecular Weight329.44 g/mol
Exact Mass329.21
IUPAC Name4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide
SMILESCc1ccc2c(CCNC(=O)N3CCC(C(C)O)CC3)c[nH]c2c1
InChIInChI=1S/C19H27N3O2/c1-13-3-4-17-16(12-21-18(17)11-13)5-8-20-19(24)22-9-6-15(7-10-22)14(2)23/h3-4,11-12,14-15,21,23H,5-10H2,1-2H3,(H,20,24)
InChIKeyYTGUHXNJSOKMQN-UHFFFAOYSA-N
XLogP2.82
TPSA68.36 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 52.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-4-[(4-fluorophenyl)-hydroxymethyl]piperidine-1-carboxamide
CID 86900823
1-cyclohexyl-3-[2-(6-methyl-1H-indol-3-yl)ethyl]urea
CID 86875661
1-[4-[(6-methyl-1H-indol-3-yl)methyl]piperidin-1-yl]ethanone
CID 146409555
N'-methyl-N-[2-(6-methyl-1H-indol-3-yl)ethyl]pyrrolidine-1-carboximidamide;hydroiodide
CID 110934410
2-(4-hydroxypiperidin-1-yl)-N-[2-(5-methyl-1H-indol-3-yl)ethyl]propanamide
CID 167780744
1-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-[2-(6-methyl-1H-indol-3-yl)ethyl]urea
CID 86880994
N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine
CID 82493176
(1R)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]-1-(oxan-4-yl)ethanamine
CID 97231176
N-[2-(6-methyl-1H-indol-3-yl)ethyl]-1-(oxan-4-yl)ethanamine
CID 84587801
4-(1-hydroxyethyl)-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]piperidine-1-carboxamide
CID 111437983
N-[2-[2-(difluoromethoxy)phenyl]ethyl]-4-[(1S)-1-hydroxyethyl]piperidine-1-carboxamide
CID 99858566
N-[2-(6-methyl-1H-indol-3-yl)ethyl]cyclopentanamine
CID 82497315

Frequently Asked Questions

What is the IUPAC name of 4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide?
The IUPAC name of 4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide (CID 111438569) is 4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide.
What is the SMILES notation for 4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide?
The canonical SMILES for 4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide is Cc1ccc2c(CCNC(=O)N3CCC(C(C)O)CC3)c[nH]c2c1.
What is the InChIKey of 4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide?
The InChIKey is YTGUHXNJSOKMQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O2/c1-13-3-4-17-16(12-21-18(17)11-13)5-8-20-19(24)22-9-6-15(7-10-22)14(2)23/h3-4,11-12,14-15,21,23H,5-10H2,1-2H3,(H,20,24).
What are the key properties of 4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide?
4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide has a molecular weight of 329.44 g/mol, XLogP of 2.82, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-hydroxyethyl)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 111438569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).