4-nonylpiperazine-1-carboxamide

C14H29N3O — CID 13213299

IUPAC4-nonylpiperazine-1-carboxamide
SMILESCCCCCCCCCN1CCN(C(N)=O)CC1
InChIInChI=1S/C14H29N3O/c1-2-3-4-5-6-7-8-9-16-10-12-17(13-11-16)14(15)18/h2-13H2,1H3,(H2,15,18)
InChIKeyMGCSKXNZRCRVJG-UHFFFAOYSA-N
MW255.41 g/mol
LogP2.43
Rot. Bonds8

About 4-nonylpiperazine-1-carboxamide

4-nonylpiperazine-1-carboxamide (PubChem CID 13213299) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 4-nonylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-nonylpiperazine-1-carboxamide
PubChem CID13213299
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name4-nonylpiperazine-1-carboxamide
SMILESCCCCCCCCCN1CCN(C(N)=O)CC1
InChIInChI=1S/C14H29N3O/c1-2-3-4-5-6-7-8-9-16-10-12-17(13-11-16)14(15)18/h2-13H2,1H3,(H2,15,18)
InChIKeyMGCSKXNZRCRVJG-UHFFFAOYSA-N
XLogP2.43
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-propylpiperazine-1-carboxamide
CID 16792615
4-octylpiperazine-1-carboxylic acid
CID 22047855
ethyl 4-hexylpiperazine-1-carboxylate
CID 78822686
1-octylaziridine
CID 544653
1,4,7-tridodecyl-1,4,7-triazonane
CID 66887116
4-(3-hydroxypropyl)piperazine-1-carboxamide
CID 138521354
1-(4-octylpiperazin-1-yl)butan-1-one
CID 170041976
(4-nonylpiperazin-1-yl)methanol
CID 574800
2-(4-hexylpiperazin-1-yl)ethanamine
CID 28913883
5-(4-nonylpiperazin-1-yl)pentan-1-amine
CID 43253095
1,4,7,10-tetraheptyl-1,4,7,10-tetrazacyclotridecane
CID 24824731
1-ethyl-4-undecylpiperazine
CID 21399231

Frequently Asked Questions

What is the IUPAC name of 4-nonylpiperazine-1-carboxamide?
The IUPAC name of 4-nonylpiperazine-1-carboxamide (CID 13213299) is 4-nonylpiperazine-1-carboxamide.
What is the SMILES notation for 4-nonylpiperazine-1-carboxamide?
The canonical SMILES for 4-nonylpiperazine-1-carboxamide is CCCCCCCCCN1CCN(C(N)=O)CC1.
What is the InChIKey of 4-nonylpiperazine-1-carboxamide?
The InChIKey is MGCSKXNZRCRVJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-2-3-4-5-6-7-8-9-16-10-12-17(13-11-16)14(15)18/h2-13H2,1H3,(H2,15,18).
What are the key properties of 4-nonylpiperazine-1-carboxamide?
4-nonylpiperazine-1-carboxamide has a molecular weight of 255.41 g/mol, XLogP of 2.43, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-nonylpiperazine-1-carboxamide is sourced from PubChem (CID 13213299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).