5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide

C13H26N4O2 — CID 63102385

IUPAC5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide
SMILESCC1CNC(C(=O)NCCCN2CCOCC2)CN1
InChIInChI=1S/C13H26N4O2/c1-11-9-16-12(10-15-11)13(18)14-3-2-4-17-5-7-19-8-6-17/h11-12,15-16H,2-10H2,1H3,(H,14,18)
InChIKeyAWYQNLYRIWNJMA-UHFFFAOYSA-N
MW270.38 g/mol
LogP-1.23
Rot. Bonds5

About 5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide

5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide (PubChem CID 63102385) has the molecular formula C13H26N4O2 and a molecular weight of 270.38 g/mol. Its IUPAC name is 5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide
PubChem CID63102385
Molecular FormulaC13H26N4O2
Molecular Weight270.38 g/mol
Exact Mass270.21
IUPAC Name5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide
SMILESCC1CNC(C(=O)NCCCN2CCOCC2)CN1
InChIInChI=1S/C13H26N4O2/c1-11-9-16-12(10-15-11)13(18)14-3-2-4-17-5-7-19-8-6-17/h11-12,15-16H,2-10H2,1H3,(H,14,18)
InChIKeyAWYQNLYRIWNJMA-UHFFFAOYSA-N
XLogP-1.23
TPSA65.63 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 5-1.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-morpholin-4-ylpropyl)piperidine-2-carboxamide;dihydrochloride
CID 119827240
(2R)-N-(4-morpholin-4-ylbutyl)piperidine-2-carboxamide
CID 119852461
N,N'-bis(3-morpholin-4-ylpropyl)propanediamide
CID 21205309
N-(2-morpholin-4-ylethyl)-5-oxopiperazine-2-carboxamide
CID 107433529
4-amino-N-(3-morpholin-4-ylpropyl)cyclohexane-1-carboxamide
CID 60846570
N-(2-morpholin-4-ylethyl)-5-(trifluoromethyl)piperidine-2-carboxamide
CID 114908559
2-amino-6-methyl-N-(3-morpholin-4-ylpropyl)cyclohexane-1-carboxamide
CID 62781177
2-(3-morpholin-4-ylpropylamino)-2-oxoacetic acid
CID 43444981
(4R)-N-(3-morpholin-4-ylpropyl)azepane-4-carboxamide
CID 125446683
N-(3-morpholin-4-ylpropyl)butanamide
CID 4162480
2-(4-methylpiperidin-1-yl)-N-(3-morpholin-4-ylpropyl)-2-oxoacetamide
CID 108504537
2-bromo-N-(3-morpholin-4-ylpropyl)acetamide
CID 52984035

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide?
The IUPAC name of 5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide (CID 63102385) is 5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide.
What is the SMILES notation for 5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide?
The canonical SMILES for 5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide is CC1CNC(C(=O)NCCCN2CCOCC2)CN1.
What is the InChIKey of 5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide?
The InChIKey is AWYQNLYRIWNJMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4O2/c1-11-9-16-12(10-15-11)13(18)14-3-2-4-17-5-7-19-8-6-17/h11-12,15-16H,2-10H2,1H3,(H,14,18).
What are the key properties of 5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide?
5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide has a molecular weight of 270.38 g/mol, XLogP of -1.23, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(3-morpholin-4-ylpropyl)piperazine-2-carboxamide is sourced from PubChem (CID 63102385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).