6-amino-N-[2-(N-methylanilino)ethyl]hexanamide

C15H25N3O — CID 61260836

IUPAC6-amino-N-[2-(N-methylanilino)ethyl]hexanamide
SMILESCN(CCNC(=O)CCCCCN)c1ccccc1
InChIInChI=1S/C15H25N3O/c1-18(14-8-4-2-5-9-14)13-12-17-15(19)10-6-3-7-11-16/h2,4-5,8-9H,3,6-7,10-13,16H2,1H3,(H,17,19)
InChIKeyNIIXJXDJNMBFOC-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.76
Rot. Bonds9

About 6-amino-N-[2-(N-methylanilino)ethyl]hexanamide

6-amino-N-[2-(N-methylanilino)ethyl]hexanamide (PubChem CID 61260836) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 6-amino-N-[2-(N-methylanilino)ethyl]hexanamide.

Molecular Properties

Compound Name6-amino-N-[2-(N-methylanilino)ethyl]hexanamide
PubChem CID61260836
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name6-amino-N-[2-(N-methylanilino)ethyl]hexanamide
SMILESCN(CCNC(=O)CCCCCN)c1ccccc1
InChIInChI=1S/C15H25N3O/c1-18(14-8-4-2-5-9-14)13-12-17-15(19)10-6-3-7-11-16/h2,4-5,8-9H,3,6-7,10-13,16H2,1H3,(H,17,19)
InChIKeyNIIXJXDJNMBFOC-UHFFFAOYSA-N
XLogP1.76
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.76
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

N-[2-(N-methylanilino)ethyl]-4-(propan-2-ylamino)butanamide
CID 61259926
5-amino-4-methyl-N-[2-(N-methylanilino)ethyl]pentanamide
CID 82012269
N-[2-(dimethylamino)ethyl]-3-(N-methylanilino)propanamide
CID 109016239
N-[3-(N-methylanilino)propyl]pentanamide
CID 78799629
3-(tert-butylamino)-N-[2-(N-methylanilino)ethyl]propanamide
CID 61260104
3-(2-aminophenyl)-N-[2-(N-methylanilino)ethyl]propanamide
CID 120612175
4-(methylamino)-N-[3-(N-methylanilino)propyl]butanamide;dihydrochloride
CID 119831619
3-(2-aminophenyl)-N-[2-(N-methylanilino)ethyl]propanamide;dihydrochloride
CID 120612174
3-amino-N-[2-(N-methylanilino)ethyl]butanamide
CID 61258847
3-(cyclopropylamino)-N-[2-(N-methylanilino)ethyl]propanamide
CID 61259203
4-amino-3-methoxy-N-[2-(N-methylanilino)ethyl]butanamide;dihydrochloride
CID 120594933
3-(2-bromophenyl)-N-[2-(N-methylanilino)ethyl]propanamide
CID 55822824

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[2-(N-methylanilino)ethyl]hexanamide?
The IUPAC name of 6-amino-N-[2-(N-methylanilino)ethyl]hexanamide (CID 61260836) is 6-amino-N-[2-(N-methylanilino)ethyl]hexanamide.
What is the SMILES notation for 6-amino-N-[2-(N-methylanilino)ethyl]hexanamide?
The canonical SMILES for 6-amino-N-[2-(N-methylanilino)ethyl]hexanamide is CN(CCNC(=O)CCCCCN)c1ccccc1.
What is the InChIKey of 6-amino-N-[2-(N-methylanilino)ethyl]hexanamide?
The InChIKey is NIIXJXDJNMBFOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-18(14-8-4-2-5-9-14)13-12-17-15(19)10-6-3-7-11-16/h2,4-5,8-9H,3,6-7,10-13,16H2,1H3,(H,17,19).
What are the key properties of 6-amino-N-[2-(N-methylanilino)ethyl]hexanamide?
6-amino-N-[2-(N-methylanilino)ethyl]hexanamide has a molecular weight of 263.38 g/mol, XLogP of 1.76, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[2-(N-methylanilino)ethyl]hexanamide is sourced from PubChem (CID 61260836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).