7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride

C16H35Cl2N3O2 — CID 119840980

IUPAC7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride
SMILESCC1CN(CCCNC(=O)CCCCCCN)CC(C)O1.Cl.Cl
InChIInChI=1S/C16H33N3O2.2ClH/c1-14-12-19(13-15(2)21-14)11-7-10-18-16(20)8-5-3-4-6-9-17;;/h14-15H,3-13,17H2,1-2H3,(H,18,20);2*1H
InChIKeyKFEGORDMTDNOLY-UHFFFAOYSA-N
MW372.38 g/mol
LogP2.35
Rot. Bonds10

About 7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride

7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride (PubChem CID 119840980) has the molecular formula C16H35Cl2N3O2 and a molecular weight of 372.38 g/mol. Its IUPAC name is 7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride.

Molecular Properties

Compound Name7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride
PubChem CID119840980
Molecular FormulaC16H35Cl2N3O2
Molecular Weight372.38 g/mol
Exact Mass371.21
IUPAC Name7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride
SMILESCC1CN(CCCNC(=O)CCCCCCN)CC(C)O1.Cl.Cl
InChIInChI=1S/C16H33N3O2.2ClH/c1-14-12-19(13-15(2)21-14)11-7-10-18-16(20)8-5-3-4-6-9-17;;/h14-15H,3-13,17H2,1-2H3,(H,18,20);2*1H
InChIKeyKFEGORDMTDNOLY-UHFFFAOYSA-N
XLogP2.35
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.38
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-amino-N-[4-(2,6-dimethylmorpholin-4-yl)butyl]butanamide;dihydrochloride
CID 119858913
7-amino-N-[3-(3,5-dimethylpiperidin-1-yl)propyl]heptanamide;dihydrochloride
CID 119851231
2-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]acetamide
CID 119841025
4-amino-N-[4-(2,6-dimethylmorpholin-4-yl)butyl]pentanamide;dihydrochloride
CID 120564879
3-(2-aminophenyl)-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]propanamide;dihydrochloride
CID 120612238
6-amino-N-(7-aminoheptyl)hexanamide
CID 56980494
N,N'-bis(12-aminododecyl)octanediamide
CID 58602052
4-tert-butyl-N-[3-[3-(2,6-dimethylmorpholin-4-yl)propylamino]-3-oxopropyl]benzamide
CID 55629039
1-[3-(2,6-dimethylmorpholin-4-yl)propyl]-2-methylguanidine;hydroiodide
CID 51131455
7-amino-N-(3-methylsulfonylpropyl)heptanamide
CID 54904867
5-amino-N-dodecylpentanamide;hydrochloride
CID 135363918
6-amino-N-pentylhexanamide;hydrochloride
CID 51041459

Frequently Asked Questions

What is the IUPAC name of 7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride?
The IUPAC name of 7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride (CID 119840980) is 7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride.
What is the SMILES notation for 7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride?
The canonical SMILES for 7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride is CC1CN(CCCNC(=O)CCCCCCN)CC(C)O1.Cl.Cl.
What is the InChIKey of 7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride?
The InChIKey is KFEGORDMTDNOLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O2.2ClH/c1-14-12-19(13-15(2)21-14)11-7-10-18-16(20)8-5-3-4-6-9-17;;/h14-15H,3-13,17H2,1-2H3,(H,18,20);2*1H.
What are the key properties of 7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride?
7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride has a molecular weight of 372.38 g/mol, XLogP of 2.35, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-N-[3-(2,6-dimethylmorpholin-4-yl)propyl]heptanamide;dihydrochloride is sourced from PubChem (CID 119840980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).