6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide

C13H26N2O2 — CID 66007023

IUPAC6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide
SMILESCC(C)(CCN)CCC(=O)NCC1CC(O)C1
InChIInChI=1S/C13H26N2O2/c1-13(2,5-6-14)4-3-12(17)15-9-10-7-11(16)8-10/h10-11,16H,3-9,14H2,1-2H3,(H,15,17)
InChIKeyCBDAYLPAAHNOJQ-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.03
Rot. Bonds7

About 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide

6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide (PubChem CID 66007023) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide.

Molecular Properties

Compound Name6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide
PubChem CID66007023
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide
SMILESCC(C)(CCN)CCC(=O)NCC1CC(O)C1
InChIInChI=1S/C13H26N2O2/c1-13(2,5-6-14)4-3-12(17)15-9-10-7-11(16)8-10/h10-11,16H,3-9,14H2,1-2H3,(H,15,17)
InChIKeyCBDAYLPAAHNOJQ-UHFFFAOYSA-N
XLogP1.03
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-N-[(3-hydroxycyclohexyl)methyl]-4,4-dimethylhexanamide
CID 106135278
6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide
CID 66005084
4-amino-N-[(3-hydroxycyclopentyl)methyl]-4-methylpentanamide
CID 106134360
2-amino-N-[(3-hydroxycyclobutyl)methyl]acetamide
CID 66005079
6-amino-N-[4-(cyclopropylamino)-4-oxobutyl]-4,4-dimethylhexanamide
CID 79401305
4-hydroxy-N-[(3-hydroxycyclobutyl)methyl]pentanamide
CID 79192566
2-[(6-amino-4,4-dimethylhexanoyl)amino]acetic acid
CID 65291863
3-(ethylamino)-N-[(3-hydroxycyclobutyl)methyl]propanamide
CID 66005719
N-[(3-hydroxycyclobutyl)methyl]dodecanamide
CID 66006246
6-amino-4,4-dimethyl-N-(3,3,3-trifluoropropyl)hexanamide
CID 65291671
5-chloro-N-[(3-hydroxycyclobutyl)methyl]pentanamide
CID 66006731
6-amino-N-(3,5-dimethylcyclohexyl)-4,4-dimethylhexanamide
CID 65291109

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide?
The IUPAC name of 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide (CID 66007023) is 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide.
What is the SMILES notation for 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide?
The canonical SMILES for 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide is CC(C)(CCN)CCC(=O)NCC1CC(O)C1.
What is the InChIKey of 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide?
The InChIKey is CBDAYLPAAHNOJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-13(2,5-6-14)4-3-12(17)15-9-10-7-11(16)8-10/h10-11,16H,3-9,14H2,1-2H3,(H,15,17).
What are the key properties of 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide?
6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide has a molecular weight of 242.36 g/mol, XLogP of 1.03, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide is sourced from PubChem (CID 66007023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).