6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide

C12H24N2O — CID 24701503

IUPAC6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide
SMILESC=C(C)CN(CC)C(=O)CCCCCN
InChIInChI=1S/C12H24N2O/c1-4-14(10-11(2)3)12(15)8-6-5-7-9-13/h2,4-10,13H2,1,3H3
InChIKeyGTPMQYXQVNLVNA-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.93
Rot. Bonds8

About 6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide

6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide (PubChem CID 24701503) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide.

Molecular Properties

Compound Name6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide
PubChem CID24701503
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide
SMILESC=C(C)CN(CC)C(=O)CCCCCN
InChIInChI=1S/C12H24N2O/c1-4-14(10-11(2)3)12(15)8-6-5-7-9-13/h2,4-10,13H2,1,3H3
InChIKeyGTPMQYXQVNLVNA-UHFFFAOYSA-N
XLogP1.93
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

7-amino-N-ethyl-N-[2-(ethylamino)-2-oxoethyl]heptanamide
CID 54878536
6-amino-N-ethyl-N-(2-hydroxyethyl)hexanamide
CID 60944687
7-amino-N-ethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]heptanamide
CID 54869086
7-amino-N-[3-(diethylamino)propyl]-N-ethylheptanamide
CID 102993033
N,N-diethyloctadecanamide;propan-1-amine;hydrobromide
CID 174816877
N-(3-aminopropyl)-N-ethyldecanamide
CID 65447961
5-amino-N-ethyl-N-(2-methylbutyl)pentanamide
CID 79470392
4-amino-N-ethyl-N-[2-(methylamino)-2-oxoethyl]butanamide
CID 43579108
7-amino-N-(cyclopropylmethyl)-N-ethylheptanamide;hydrochloride
CID 119784610
3-[6-aminohexanoyl(ethyl)amino]-2-methylpropanoic acid
CID 62852815
7-amino-N-(2-cyanopropyl)-N-ethylheptanamide
CID 54873246
N'-ethyl-N'-(2-methylprop-2-enyl)hexane-1,6-diamine
CID 28599551

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide?
The IUPAC name of 6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide (CID 24701503) is 6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide.
What is the SMILES notation for 6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide?
The canonical SMILES for 6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide is C=C(C)CN(CC)C(=O)CCCCCN.
What is the InChIKey of 6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide?
The InChIKey is GTPMQYXQVNLVNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-4-14(10-11(2)3)12(15)8-6-5-7-9-13/h2,4-10,13H2,1,3H3.
What are the key properties of 6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide?
6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide has a molecular weight of 212.34 g/mol, XLogP of 1.93, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-ethyl-N-(2-methylprop-2-enyl)hexanamide is sourced from PubChem (CID 24701503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).