4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide

C20H32N4O2 — CID 121495919

IUPAC4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide
SMILESO=C(NCCN1CCCC(c2ccccc2)C1)N1CCN(CCO)CC1
InChIInChI=1S/C20H32N4O2/c25-16-15-22-11-13-24(14-12-22)20(26)21-8-10-23-9-4-7-19(17-23)18-5-2-1-3-6-18/h1-3,5-6,19,25H,4,7-17H2,(H,21,26)
InChIKeyJLFYPOIWKKBVQP-UHFFFAOYSA-N
MW360.50 g/mol
LogP1.19
Rot. Bonds6

About 4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide

4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide (PubChem CID 121495919) has the molecular formula C20H32N4O2 and a molecular weight of 360.50 g/mol. Its IUPAC name is 4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide
PubChem CID121495919
Molecular FormulaC20H32N4O2
Molecular Weight360.50 g/mol
Exact Mass360.25
IUPAC Name4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide
SMILESO=C(NCCN1CCCC(c2ccccc2)C1)N1CCN(CCO)CC1
InChIInChI=1S/C20H32N4O2/c25-16-15-22-11-13-24(14-12-22)20(26)21-8-10-23-9-4-7-19(17-23)18-5-2-1-3-6-18/h1-3,5-6,19,25H,4,7-17H2,(H,21,26)
InChIKeyJLFYPOIWKKBVQP-UHFFFAOYSA-N
XLogP1.19
TPSA59.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.50
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methylsulfonyl-N-[2-[(3R)-3-phenylpiperidin-1-yl]ethyl]acetamide
CID 95230194
N-[2-(3-phenylpiperidin-1-yl)ethyl]-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 72921846
2,6-dimethyl-N-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine-4-carboxamide
CID 77085424
2-cyclopropyl-N-[2-(3-phenylpiperidin-1-yl)ethyl]pyrimidine-5-carboxamide
CID 131915442
N-[2-[(3S)-3-phenylpiperidin-1-yl]ethyl]-1H-imidazole-2-carboxamide
CID 95193540
4-(3-phenylpiperidin-1-yl)butanoic acid
CID 156599277
2-oxo-N-[2-[(3R)-3-phenylpiperidin-1-yl]ethyl]-1H-quinoline-4-carboxamide
CID 97445389
N-[2-(3-phenylpiperidin-1-yl)ethyl]-6-(1,2,4-triazol-4-yl)pyridine-2-carboxamide
CID 74249904
(3R,5R)-1-N-butyl-5-phenyl-3-N-(2-pyrrolidin-1-ylethyl)piperidine-1,3-dicarboxamide
CID 92995666
N-[2-[(3S)-3-(hydroxymethyl)piperidin-1-yl]ethyl]-4-(pyridin-2-ylmethyl)-1,4-diazepane-1-carboxamide
CID 126426454
N-[2-(3-phenylpiperidin-1-yl)ethyl]-2-(3,4,5-trimethylpyrazol-1-yl)acetamide
CID 77086601
(4S)-N-(2-imidazol-1-ylethyl)-4-phenylazepane-1-carboxamide
CID 95186692

Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide?
The IUPAC name of 4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide (CID 121495919) is 4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide.
What is the SMILES notation for 4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide?
The canonical SMILES for 4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide is O=C(NCCN1CCCC(c2ccccc2)C1)N1CCN(CCO)CC1.
What is the InChIKey of 4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide?
The InChIKey is JLFYPOIWKKBVQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32N4O2/c25-16-15-22-11-13-24(14-12-22)20(26)21-8-10-23-9-4-7-19(17-23)18-5-2-1-3-6-18/h1-3,5-6,19,25H,4,7-17H2,(H,21,26).
What are the key properties of 4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide?
4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide has a molecular weight of 360.50 g/mol, XLogP of 1.19, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxyethyl)-N-[2-(3-phenylpiperidin-1-yl)ethyl]piperazine-1-carboxamide is sourced from PubChem (CID 121495919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).