6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide

C14H30N2O2 — CID 79379068

IUPAC6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide
SMILESCCN(CC(C)(C)O)C(=O)CCC(C)(C)CCN
InChIInChI=1S/C14H30N2O2/c1-6-16(11-14(4,5)18)12(17)7-8-13(2,3)9-10-15/h18H,6-11,15H2,1-5H3
InChIKeyMBVDDXYWEYYMHR-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.76
Rot. Bonds8

About 6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide

6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide (PubChem CID 79379068) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide.

Molecular Properties

Compound Name6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide
PubChem CID79379068
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide
SMILESCCN(CC(C)(C)O)C(=O)CCC(C)(C)CCN
InChIInChI=1S/C14H30N2O2/c1-6-16(11-14(4,5)18)12(17)7-8-13(2,3)9-10-15/h18H,6-11,15H2,1-5H3
InChIKeyMBVDDXYWEYYMHR-UHFFFAOYSA-N
XLogP1.76
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(tert-butylamino)-N-ethyl-N-(2-hydroxy-2-methylpropyl)propanamide
CID 79377535
6-amino-N-ethyl-4,4-dimethyl-N-(pyridin-4-ylmethyl)hexanamide
CID 65292091
6-amino-N-ethyl-4,4-dimethyl-N-propan-2-ylhexanamide
CID 65292760
3-[ethyl-(2-hydroxy-2-methylpropyl)amino]-3-oxopropanoic acid
CID 79385431
6-amino-N-butyl-N-(2-hydroxyethyl)-4,4-dimethylhexanamide
CID 65290826
6-amino-N-ethyl-4,4-dimethyl-N-(oxolan-2-ylmethyl)hexanamide
CID 65292320
N-ethyl-N-(2-hydroxy-2-methylpropyl)pent-4-ynamide
CID 106741540
N-[4-[ethyl-(2-hydroxy-2-methylpropyl)amino]-4-oxobutyl]-2,2-dimethylpropanamide
CID 79387815
6-amino-N-[1-(diethylamino)-1-oxopropan-2-yl]-4,4-dimethylhexanamide
CID 65290645
N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-methylbutanamide
CID 79387562
4-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-3-methoxybutanamide
CID 103156201
2-[(6-amino-4,4-dimethylhexanoyl)-(cyclopropylmethyl)amino]acetic acid
CID 65292062

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide?
The IUPAC name of 6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide (CID 79379068) is 6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide.
What is the SMILES notation for 6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide?
The canonical SMILES for 6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide is CCN(CC(C)(C)O)C(=O)CCC(C)(C)CCN.
What is the InChIKey of 6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide?
The InChIKey is MBVDDXYWEYYMHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-6-16(11-14(4,5)18)12(17)7-8-13(2,3)9-10-15/h18H,6-11,15H2,1-5H3.
What are the key properties of 6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide?
6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide has a molecular weight of 258.41 g/mol, XLogP of 1.76, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-ethyl-N-(2-hydroxy-2-methylpropyl)-4,4-dimethylhexanamide is sourced from PubChem (CID 79379068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).