N-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide

C8H16N2O2 — CID 107529605

IUPACN-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide
SMILESCC(=O)NCCNC1CC(O)C1
InChIInChI=1S/C8H16N2O2/c1-6(11)9-2-3-10-7-4-8(12)5-7/h7-8,10,12H,2-5H2,1H3,(H,9,11)
InChIKeyWFZQVJTYCXESEA-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.76
Rot. Bonds4

About N-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide

N-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide (PubChem CID 107529605) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is N-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide
PubChem CID107529605
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC NameN-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide
SMILESCC(=O)NCCNC1CC(O)C1
InChIInChI=1S/C8H16N2O2/c1-6(11)9-2-3-10-7-4-8(12)5-7/h7-8,10,12H,2-5H2,1H3,(H,9,11)
InChIKeyWFZQVJTYCXESEA-UHFFFAOYSA-N
XLogP-0.76
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(cyclononylamino)ethyl]acetamide
CID 154969023
N-[2-[(3-phenylcyclobutyl)amino]ethyl]acetamide
CID 43632255
N-[2-[(3-aminocyclohexyl)amino]ethyl]acetamide
CID 79459016
N-[2-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]ethyl]acetamide
CID 106658128
N-[2-[[3-(2-methylphenyl)cyclobutyl]amino]ethyl]acetamide
CID 43634648
N-[3-(cyclopropylamino)propyl]acetamide
CID 43596501
N-[2-[(1-methylsulfonylpiperidin-4-yl)amino]ethyl]acetamide
CID 102673469
N-[2-(azepan-4-ylamino)ethyl]acetamide
CID 103980758
N-[2-[[3-(3-bromophenyl)cyclobutyl]amino]ethyl]acetamide
CID 43634641
N-[2-[(2-methylcyclopentyl)amino]ethyl]acetamide
CID 65046344
N-[2-[[1-(2-methylpropyl)piperidin-4-yl]amino]ethyl]acetamide
CID 102673464
ethyl 4-(2-acetamidoethylamino)piperidine-1-carboxylate
CID 43226799

Frequently Asked Questions

What is the IUPAC name of N-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide?
The IUPAC name of N-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide (CID 107529605) is N-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide.
What is the SMILES notation for N-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide?
The canonical SMILES for N-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide is CC(=O)NCCNC1CC(O)C1.
What is the InChIKey of N-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide?
The InChIKey is WFZQVJTYCXESEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-6(11)9-2-3-10-7-4-8(12)5-7/h7-8,10,12H,2-5H2,1H3,(H,9,11).
What are the key properties of N-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide?
N-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide has a molecular weight of 172.23 g/mol, XLogP of -0.76, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(3-hydroxycyclobutyl)amino]ethyl]acetamide is sourced from PubChem (CID 107529605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).