4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide

C14H27N3O2 — CID 103991580

IUPAC4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide
SMILESCOC1(CNC2CCN(C(=O)N(C)C)CC2)CCC1
InChIInChI=1S/C14H27N3O2/c1-16(2)13(18)17-9-5-12(6-10-17)15-11-14(19-3)7-4-8-14/h12,15H,4-11H2,1-3H3
InChIKeyFQRMHXJVNZCIFA-UHFFFAOYSA-N
MW269.39 g/mol
LogP1.29
Rot. Bonds4

About 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide

4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide (PubChem CID 103991580) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide
PubChem CID103991580
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide
SMILESCOC1(CNC2CCN(C(=O)N(C)C)CC2)CCC1
InChIInChI=1S/C14H27N3O2/c1-16(2)13(18)17-9-5-12(6-10-17)15-11-14(19-3)7-4-8-14/h12,15H,4-11H2,1-3H3
InChIKeyFQRMHXJVNZCIFA-UHFFFAOYSA-N
XLogP1.29
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide?
The IUPAC name of 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide (CID 103991580) is 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide?
The canonical SMILES for 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide is COC1(CNC2CCN(C(=O)N(C)C)CC2)CCC1.
What is the InChIKey of 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide?
The InChIKey is FQRMHXJVNZCIFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-16(2)13(18)17-9-5-12(6-10-17)15-11-14(19-3)7-4-8-14/h12,15H,4-11H2,1-3H3.
What are the key properties of 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide?
4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide has a molecular weight of 269.39 g/mol, XLogP of 1.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1-methoxycyclobutyl)methylamino]-N,N-dimethylpiperidine-1-carboxamide is sourced from PubChem (CID 103991580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).