6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide

C15H33N3O — CID 24702267

IUPAC6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide
SMILESCCN(CC)CCCC(C)NC(=O)CCCCCN
InChIInChI=1S/C15H33N3O/c1-4-18(5-2)13-9-10-14(3)17-15(19)11-7-6-8-12-16/h14H,4-13,16H2,1-3H3,(H,17,19)
InChIKeyJUJHLVRSIAAJLB-UHFFFAOYSA-N
MW271.45 g/mol
LogP2.13
Rot. Bonds12

About 6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide

6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide (PubChem CID 24702267) has the molecular formula C15H33N3O and a molecular weight of 271.45 g/mol. Its IUPAC name is 6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide.

Molecular Properties

Compound Name6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide
PubChem CID24702267
Molecular FormulaC15H33N3O
Molecular Weight271.45 g/mol
Exact Mass271.26
IUPAC Name6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide
SMILESCCN(CC)CCCC(C)NC(=O)CCCCCN
InChIInChI=1S/C15H33N3O/c1-4-18(5-2)13-9-10-14(3)17-15(19)11-7-6-8-12-16/h14H,4-13,16H2,1-3H3,(H,17,19)
InChIKeyJUJHLVRSIAAJLB-UHFFFAOYSA-N
XLogP2.13
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 52.13
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

5-bromo-N-[5-(diethylamino)pentan-2-yl]pentanamide
CID 114014573
N-[5-(diethylamino)pentan-2-yl]butanamide
CID 60707663
N-(6-aminohexan-2-yl)octanamide
CID 123172105
N-[5-(diethylamino)pentan-2-yl]propanamide
CID 60707685
2-[3-aminopropyl(ethyl)amino]-N-pentan-2-ylacetamide
CID 61490080
5-amino-N-(4-hydroxybutan-2-yl)pentanamide
CID 83177679
7-amino-N-(1-methoxypropan-2-yl)heptanamide
CID 24700699
7-amino-N-(5,5-dimethylhexan-2-yl)heptanamide
CID 119796530
N-(2-aminoethyl)-N'-[5-(diethylamino)pentan-2-yl]oxamide
CID 43316024
N-(4-aminobutan-2-yl)octanamide
CID 62087208
4-amino-N-[5-(diethylamino)pentan-2-yl]-3-methoxybutanamide
CID 103154141
6-(5-aminopentanoylamino)-2-methylheptanoic acid
CID 65286275

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide?
The IUPAC name of 6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide (CID 24702267) is 6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide.
What is the SMILES notation for 6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide?
The canonical SMILES for 6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide is CCN(CC)CCCC(C)NC(=O)CCCCCN.
What is the InChIKey of 6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide?
The InChIKey is JUJHLVRSIAAJLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3O/c1-4-18(5-2)13-9-10-14(3)17-15(19)11-7-6-8-12-16/h14H,4-13,16H2,1-3H3,(H,17,19).
What are the key properties of 6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide?
6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide has a molecular weight of 271.45 g/mol, XLogP of 2.13, 12 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[5-(diethylamino)pentan-2-yl]hexanamide is sourced from PubChem (CID 24702267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).