6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide

C16H33N3O — CID 60981769

IUPAC6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide
SMILESCN(CCCNC(=O)CCCCCN)C1CCCCC1
InChIInChI=1S/C16H33N3O/c1-19(15-9-4-2-5-10-15)14-8-13-18-16(20)11-6-3-7-12-17/h15H,2-14,17H2,1H3,(H,18,20)
InChIKeyUPLRDIHZKUTWGL-UHFFFAOYSA-N
MW283.46 g/mol
LogP2.28
Rot. Bonds10

About 6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide

6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide (PubChem CID 60981769) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is 6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide.

Molecular Properties

Compound Name6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide
PubChem CID60981769
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC Name6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide
SMILESCN(CCCNC(=O)CCCCCN)C1CCCCC1
InChIInChI=1S/C16H33N3O/c1-19(15-9-4-2-5-10-15)14-8-13-18-16(20)11-6-3-7-12-17/h15H,2-14,17H2,1H3,(H,18,20)
InChIKeyUPLRDIHZKUTWGL-UHFFFAOYSA-N
XLogP2.28
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]butanamide
CID 63316373
4-amino-N-[2-[cyclopentyl(methyl)amino]ethyl]butanamide;dihydrochloride
CID 119878781
2-(2-aminoethoxy)-N-[3-[cyclohexyl(methyl)amino]propyl]acetamide
CID 79473004
3-[3-[cyclohexyl(methyl)amino]propylamino]-3-oxopropanoic acid
CID 62230930
N-[2-[cyclohexyl(methyl)amino]ethyl]pentanamide
CID 86848662
4-[cyclohexyl(methyl)amino]butanehydrazide
CID 63568701
4-[cycloheptyl(methyl)amino]butanehydrazide
CID 63571638
N-(2-aminoethyl)-2-[cyclopentyl(methyl)amino]acetamide
CID 61207694
2-amino-N-[3-[cyclohexyl(methyl)amino]propyl]propanamide
CID 54880376
N-[2-[cyclohexyl(methyl)amino]ethyl]-4-ethoxybutanamide
CID 86848639
3-[5-[cyclohexyl(methyl)amino]pentyl]-1,1-dimethylurea
CID 110443807
3-amino-N-[3-[cyclohexyl(methyl)amino]propyl]-2,2,3-trimethylbutanamide
CID 65269336

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide?
The IUPAC name of 6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide (CID 60981769) is 6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide.
What is the SMILES notation for 6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide?
The canonical SMILES for 6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide is CN(CCCNC(=O)CCCCCN)C1CCCCC1.
What is the InChIKey of 6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide?
The InChIKey is UPLRDIHZKUTWGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-19(15-9-4-2-5-10-15)14-8-13-18-16(20)11-6-3-7-12-17/h15H,2-14,17H2,1H3,(H,18,20).
What are the key properties of 6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide?
6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide has a molecular weight of 283.46 g/mol, XLogP of 2.28, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[3-[cyclohexyl(methyl)amino]propyl]hexanamide is sourced from PubChem (CID 60981769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).