4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide

C8H17N3O2 — CID 53426202

IUPAC4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide
SMILESCNC(=O)N1CCN(CCO)CC1
InChIInChI=1S/C8H17N3O2/c1-9-8(13)11-4-2-10(3-5-11)6-7-12/h12H,2-7H2,1H3,(H,9,13)
InChIKeyWLNUHWJKVHLZLX-UHFFFAOYSA-N
MW187.24 g/mol
LogP-1.06
Rot. Bonds2

About 4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide

4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide (PubChem CID 53426202) has the molecular formula C8H17N3O2 and a molecular weight of 187.24 g/mol. Its IUPAC name is 4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide
PubChem CID53426202
Molecular FormulaC8H17N3O2
Molecular Weight187.24 g/mol
Exact Mass187.13
IUPAC Name4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide
SMILESCNC(=O)N1CCN(CCO)CC1
InChIInChI=1S/C8H17N3O2/c1-9-8(13)11-4-2-10(3-5-11)6-7-12/h12H,2-7H2,1H3,(H,9,13)
InChIKeyWLNUHWJKVHLZLX-UHFFFAOYSA-N
XLogP-1.06
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 5-1.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-Ethyl-3-(2-morpholinoethyl)urea
CID 307328
4-(2-Hydroxyethyl)piperazine-1-carboxamide
CID 4742514
N-butyl-4-(2-hydroxyethyl)piperazine-1-carboxamide
CID 6457939
N-(3-hydroxypropyl)-4-methylpiperazine-1-carboxamide
CID 127574854
Oxycarbamazine
CID 129851341
N-(dimethylcarbamoyl)-4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide
CID 3066986
2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide
CID 88741446
1-Methyl-3-[2-(morpholin-4-yl)ethyl]urea
CID 16645811
4-(2-hydroxyethyl)-N-(trifluoromethyl)piperazine-1-carboxamide
CID 108865944
4-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)piperazine-1-carboxamide
CID 113230177
[4-(2-hydroxyethyl)piperazinyl]-N-propylcarboxamide
CID 6459269
4-(2-hydroxypropyl)-N-isopropylpiperazine-1-carboxamide hydrochloride
CID 71783481

Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide?
The IUPAC name of 4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide (CID 53426202) is 4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide.
What is the SMILES notation for 4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide?
The canonical SMILES for 4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide is CNC(=O)N1CCN(CCO)CC1.
What is the InChIKey of 4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide?
The InChIKey is WLNUHWJKVHLZLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O2/c1-9-8(13)11-4-2-10(3-5-11)6-7-12/h12H,2-7H2,1H3,(H,9,13).
What are the key properties of 4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide?
4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide has a molecular weight of 187.24 g/mol, XLogP of -1.06, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxyethyl)-N-methylpiperazine-1-carboxamide is sourced from PubChem (CID 53426202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).