6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide

C14H30N2O2 — CID 114176914

IUPAC6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide
SMILESCCC(CCN)CCC(=O)NC(CCO)C(C)C
InChIInChI=1S/C14H30N2O2/c1-4-12(7-9-15)5-6-14(18)16-13(8-10-17)11(2)3/h11-13,17H,4-10,15H2,1-3H3,(H,16,18)
InChIKeyYDQUGGFLDPEMKK-UHFFFAOYSA-N
MW258.41 g/mol
LogP1.66
Rot. Bonds10

About 6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide

6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide (PubChem CID 114176914) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide.

Molecular Properties

Compound Name6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide
PubChem CID114176914
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide
SMILESCCC(CCN)CCC(=O)NC(CCO)C(C)C
InChIInChI=1S/C14H30N2O2/c1-4-12(7-9-15)5-6-14(18)16-13(8-10-17)11(2)3/h11-13,17H,4-10,15H2,1-3H3,(H,16,18)
InChIKeyYDQUGGFLDPEMKK-UHFFFAOYSA-N
XLogP1.66
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 51.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 97012317
Ethylhexanamide serinol
CID 65314993
Canamide
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[2-(Hydroxymethyl)-7-oxo-7-(propan-2-ylamino)heptyl] hypofluorite
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4-(2-Fluoroethyl)-5-(2-hydroxyethyl)pyrrolidin-2-one
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(s)-N-lauroyl leucinol
CID 129847196
4,4-difluoro-N-(4-hydroxybutan-2-yl)cyclohexane-1-carboxamide
CID 81966971
4,4-difluoro-N-(1-hydroxy-4-methylpentan-3-yl)cyclohexane-1-carboxamide
CID 103860185
6-amino-N-(2,2-difluoro-3-hydroxypropyl)-4-methylhexanamide
CID 106176663
6-amino-N-(2,2-difluoro-3-hydroxypropyl)-2-methylheptanamide
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N-(1-hydroxy-4-methylpentan-3-yl)-4-(trifluoromethyl)cyclohexane-1-carboxamide
CID 106834387

Frequently Asked Questions

What is the IUPAC name of 6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide?
The IUPAC name of 6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide (CID 114176914) is 6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide.
What is the SMILES notation for 6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide?
The canonical SMILES for 6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide is CCC(CCN)CCC(=O)NC(CCO)C(C)C.
What is the InChIKey of 6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide?
The InChIKey is YDQUGGFLDPEMKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-4-12(7-9-15)5-6-14(18)16-13(8-10-17)11(2)3/h11-13,17H,4-10,15H2,1-3H3,(H,16,18).
What are the key properties of 6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide?
6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide has a molecular weight of 258.41 g/mol, XLogP of 1.66, 10 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-4-ethyl-N-(1-hydroxy-4-methylpentan-3-yl)hexanamide is sourced from PubChem (CID 114176914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).