6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide

C13H28N2O — CID 65292760

IUPAC6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide
SMILESCCN(C(=O)CCC(C)(C)CCN)C(C)C
InChIInChI=1S/C13H28N2O/c1-6-15(11(2)3)12(16)7-8-13(4,5)9-10-14/h11H,6-10,14H2,1-5H3
InChIKeyLPQVYTSRIOAPEH-UHFFFAOYSA-N
MW228.38 g/mol
LogP2.40
Rot. Bonds7

About 6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide

6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide (PubChem CID 65292760) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide.

Molecular Properties

Compound Name6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide
PubChem CID65292760
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide
SMILESCCN(C(=O)CCC(C)(C)CCN)C(C)C
InChIInChI=1S/C13H28N2O/c1-6-15(11(2)3)12(16)7-8-13(4,5)9-10-14/h11H,6-10,14H2,1-5H3
InChIKeyLPQVYTSRIOAPEH-UHFFFAOYSA-N
XLogP2.40
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-amino-N-butan-2-yl-N-butyl-4,4-dimethylhexanamide
CID 65290924
6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide
CID 79379068
6-amino-N-(1-cyclopropylethyl)-4,4-dimethyl-N-(2,2,2-trifluoroethyl)hexanamide
CID 65290581
6-[[ethyl(propan-2-yl)carbamoyl]amino]-4,4-dimethylhexanoic acid
CID 65289831
6-amino-N-[1-(diethylamino)-1-oxopropan-2-yl]-4,4-dimethylhexanamide
CID 65290645
6-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-4,4-dimethylhexanamide
CID 103109224
3-amino-N-butan-2-yl-N-ethylpropanamide
CID 43274458
ethyl N-ethyl-N-propan-2-ylcarbamate
CID 61216466
6-amino-N,4,4-trimethyl-N-(1-phenylethyl)hexanamide
CID 65290678
6-amino-N-butyl-N-(2-hydroxyethyl)-4,4-dimethylhexanamide
CID 65290826
3-amino-N-propan-2-yl-N-propylpropanamide
CID 43269470
6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide
CID 65292091

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide?
The IUPAC name of 6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide (CID 65292760) is 6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide.
What is the SMILES notation for 6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide?
The canonical SMILES for 6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide is CCN(C(=O)CCC(C)(C)CCN)C(C)C.
What is the InChIKey of 6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide?
The InChIKey is LPQVYTSRIOAPEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-6-15(11(2)3)12(16)7-8-13(4,5)9-10-14/h11H,6-10,14H2,1-5H3.
What are the key properties of 6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide?
6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide has a molecular weight of 228.38 g/mol, XLogP of 2.40, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide is sourced from PubChem (CID 65292760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).