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

C12H24N2O2 — CID 66005084

IUPAC6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide
SMILESCC(CCN)CCC(=O)NCC1CC(O)C1
InChIInChI=1S/C12H24N2O2/c1-9(4-5-13)2-3-12(16)14-8-10-6-11(15)7-10/h9-11,15H,2-8,13H2,1H3,(H,14,16)
InChIKeyIJKMCXXWBJYYQF-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.64
Rot. Bonds7

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

6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide (PubChem CID 66005084) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide.

Molecular Properties

Compound Name6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide
PubChem CID66005084
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide
SMILESCC(CCN)CCC(=O)NCC1CC(O)C1
InChIInChI=1S/C12H24N2O2/c1-9(4-5-13)2-3-12(16)14-8-10-6-11(15)7-10/h9-11,15H,2-8,13H2,1H3,(H,14,16)
InChIKeyIJKMCXXWBJYYQF-UHFFFAOYSA-N
XLogP0.64
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydroxy-N-[(3-hydroxycyclobutyl)methyl]pentanamide
CID 79192566
6-amino-N-[(3-hydroxycyclobutyl)methyl]-4,4-dimethylhexanamide
CID 66007023
2-amino-N-[(3-hydroxycyclobutyl)methyl]acetamide
CID 66005079
4-(2-aminoethyl)-N-[(4-hydroxycyclohexyl)methyl]-5,5-dimethylhexanamide
CID 106135446
N-[(3-hydroxycyclobutyl)methyl]dodecanamide
CID 66006246
3-(ethylamino)-N-[(3-hydroxycyclobutyl)methyl]propanamide
CID 66005719
N-[(3-hydroxycyclopentyl)methyl]-4-methoxypentanamide
CID 103280773
5-chloro-N-[(3-hydroxycyclobutyl)methyl]pentanamide
CID 66006731
N-ethyl-3-[(3-hydroxycyclobutyl)methylamino]propanamide
CID 66005260
5-amino-N-[(3-hydroxycyclohexyl)methyl]hexanamide
CID 114148164
6-amino-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-4-methylhexanamide
CID 65119052
(3-hydroxycyclobutyl)methylurea
CID 66005226

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide?
The IUPAC name of 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide (CID 66005084) is 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide.
What is the SMILES notation for 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide?
The canonical SMILES for 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide is CC(CCN)CCC(=O)NCC1CC(O)C1.
What is the InChIKey of 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide?
The InChIKey is IJKMCXXWBJYYQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-9(4-5-13)2-3-12(16)14-8-10-6-11(15)7-10/h9-11,15H,2-8,13H2,1H3,(H,14,16).
What are the key properties of 6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide?
6-amino-N-[(3-hydroxycyclobutyl)methyl]-4-methylhexanamide has a molecular weight of 228.34 g/mol, XLogP of 0.64, 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-methylhexanamide is sourced from PubChem (CID 66005084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).