N,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide

C21H39N3O — CID 67746921

IUPACN,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide
SMILESO=C(CNCCN1CCCCC1)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C21H39N3O/c25-21(18-22-14-17-23-15-8-3-9-16-23)24(19-10-4-1-5-11-19)20-12-6-2-7-13-20/h19-20,22H,1-18H2
InChIKeyFPKHXLVSPCJOTI-UHFFFAOYSA-N
MW349.56 g/mol
LogP3.56
Rot. Bonds7

About N,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide

N,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide (PubChem CID 67746921) has the molecular formula C21H39N3O and a molecular weight of 349.56 g/mol. Its IUPAC name is N,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide.

Molecular Properties

Compound NameN,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide
PubChem CID67746921
Molecular FormulaC21H39N3O
Molecular Weight349.56 g/mol
Exact Mass349.31
IUPAC NameN,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide
SMILESO=C(CNCCN1CCCCC1)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C21H39N3O/c25-21(18-22-14-17-23-15-8-3-9-16-23)24(19-10-4-1-5-11-19)20-12-6-2-7-13-20/h19-20,22H,1-18H2
InChIKeyFPKHXLVSPCJOTI-UHFFFAOYSA-N
XLogP3.56
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.56
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2-piperidin-1-ylethylamino)acetamide
CID 60695664
2-(2-pyrrolidin-1-ylethylamino)acetamide
CID 60673194
N-(4-cyclohexylphenyl)-2-(2-pyrrolidin-1-ylethylamino)acetamide
CID 22448118
N,N-dicyclohexyl-3-(cyclopropylamino)propanamide
CID 60842293
N,N-dicyclohexyl-5-morpholin-4-ylpentanamide
CID 67746963
N,N-dicyclohexyl-2-[(3S)-3-hydroxypiperidin-1-yl]acetamide
CID 94191195
2-pyrrolidin-1-yl-N-(2-pyrrolidin-1-ylethyl)ethanamine
CID 19869583
N,N-dicyclohexyl-2-iodoacetamide
CID 71405486
N-(2-iodoethyl)-2-piperidin-1-ylethanamine
CID 122495031
N',N'-dicyclohexyl-N-hydroxypropanediamide
CID 3049615
N-(2-cyanoethyl)-2-(2-pyrrolidin-1-ylethylamino)acetamide
CID 60697915
N'-hydroxy-2-(2-piperidin-1-ylethylamino)ethanimidamide
CID 77031116

Frequently Asked Questions

What is the IUPAC name of N,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide?
The IUPAC name of N,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide (CID 67746921) is N,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide.
What is the SMILES notation for N,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide?
The canonical SMILES for N,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide is O=C(CNCCN1CCCCC1)N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of N,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide?
The InChIKey is FPKHXLVSPCJOTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H39N3O/c25-21(18-22-14-17-23-15-8-3-9-16-23)24(19-10-4-1-5-11-19)20-12-6-2-7-13-20/h19-20,22H,1-18H2.
What are the key properties of N,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide?
N,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide has a molecular weight of 349.56 g/mol, XLogP of 3.56, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexyl-2-(2-piperidin-1-ylethylamino)acetamide is sourced from PubChem (CID 67746921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).