5-[(3-methyloxetan-3-yl)methylamino]pentanamide

C10H20N2O2 — CID 106233481

IUPAC5-[(3-methyloxetan-3-yl)methylamino]pentanamide
SMILESCC1(CNCCCCC(N)=O)COC1
InChIInChI=1S/C10H20N2O2/c1-10(7-14-8-10)6-12-5-3-2-4-9(11)13/h12H,2-8H2,1H3,(H2,11,13)
InChIKeySIJQXWKPYSNIOZ-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.27
Rot. Bonds7

About 5-[(3-methyloxetan-3-yl)methylamino]pentanamide

5-[(3-methyloxetan-3-yl)methylamino]pentanamide (PubChem CID 106233481) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 5-[(3-methyloxetan-3-yl)methylamino]pentanamide.

Molecular Properties

Compound Name5-[(3-methyloxetan-3-yl)methylamino]pentanamide
PubChem CID106233481
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name5-[(3-methyloxetan-3-yl)methylamino]pentanamide
SMILESCC1(CNCCCCC(N)=O)COC1
InChIInChI=1S/C10H20N2O2/c1-10(7-14-8-10)6-12-5-3-2-4-9(11)13/h12H,2-8H2,1H3,(H2,11,13)
InChIKeySIJQXWKPYSNIOZ-UHFFFAOYSA-N
XLogP0.27
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-[(1,4-dimethylpiperidin-4-yl)methylamino]pentanamide
CID 114281626
3-[(3-methyloxetan-3-yl)methylamino]-1-pyrrolidin-1-ylpropan-1-one
CID 115666768
2-methyl-5-[(3-methyloxetan-3-yl)methylamino]pentan-1-ol
CID 106157430
12-(hexylamino)dodecanamide
CID 174861179
6-(decylamino)hexanamide
CID 13292350
N-[(3-methyloxetan-3-yl)methyl]-2-propan-2-ylsulfonylethanamine
CID 106724002
N-[(3-methyloxetan-3-yl)methyl]pent-3-yn-1-amine
CID 104807224
2-(3-methoxypropoxy)-N-[(3-methyloxetan-3-yl)methyl]ethanamine
CID 103179188
tert-butyl N-tert-butyl-N-[2-[(3-methyloxetan-3-yl)methylamino]ethyl]carbamate
CID 107445850
4-[(1-hydroxycycloheptyl)methylamino]butanamide
CID 60908501
methyl 3-[(5-amino-5-oxopentyl)amino]-2-methylpropanoate
CID 106237219
3-amino-N-(5-amino-5-oxopentyl)oxolane-3-carboxamide
CID 106235837

Frequently Asked Questions

What is the IUPAC name of 5-[(3-methyloxetan-3-yl)methylamino]pentanamide?
The IUPAC name of 5-[(3-methyloxetan-3-yl)methylamino]pentanamide (CID 106233481) is 5-[(3-methyloxetan-3-yl)methylamino]pentanamide.
What is the SMILES notation for 5-[(3-methyloxetan-3-yl)methylamino]pentanamide?
The canonical SMILES for 5-[(3-methyloxetan-3-yl)methylamino]pentanamide is CC1(CNCCCCC(N)=O)COC1.
What is the InChIKey of 5-[(3-methyloxetan-3-yl)methylamino]pentanamide?
The InChIKey is SIJQXWKPYSNIOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-10(7-14-8-10)6-12-5-3-2-4-9(11)13/h12H,2-8H2,1H3,(H2,11,13).
What are the key properties of 5-[(3-methyloxetan-3-yl)methylamino]pentanamide?
5-[(3-methyloxetan-3-yl)methylamino]pentanamide has a molecular weight of 200.28 g/mol, XLogP of 0.27, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-methyloxetan-3-yl)methylamino]pentanamide is sourced from PubChem (CID 106233481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).