N,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide

C13H25N3O — CID 170078871

IUPACN,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide
SMILESCC1CC(N2CCN(C(=O)N(C)C)CC2C)C1
InChIInChI=1S/C13H25N3O/c1-10-7-12(8-10)16-6-5-15(9-11(16)2)13(17)14(3)4/h10-12H,5-9H2,1-4H3
InChIKeyCIOQFMKBCJPTHC-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.47
Rot. Bonds1

About N,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide

N,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide (PubChem CID 170078871) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is N,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide
PubChem CID170078871
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC NameN,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide
SMILESCC1CC(N2CCN(C(=O)N(C)C)CC2C)C1
InChIInChI=1S/C13H25N3O/c1-10-7-12(8-10)16-6-5-15(9-11(16)2)13(17)14(3)4/h10-12H,5-9H2,1-4H3
InChIKeyCIOQFMKBCJPTHC-UHFFFAOYSA-N
XLogP1.47
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide?
The IUPAC name of N,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide (CID 170078871) is N,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide.
What is the SMILES notation for N,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide?
The canonical SMILES for N,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide is CC1CC(N2CCN(C(=O)N(C)C)CC2C)C1.
What is the InChIKey of N,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide?
The InChIKey is CIOQFMKBCJPTHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-10-7-12(8-10)16-6-5-15(9-11(16)2)13(17)14(3)4/h10-12H,5-9H2,1-4H3.
What are the key properties of N,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide?
N,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 1.47, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3-trimethyl-4-(3-methylcyclobutyl)piperazine-1-carboxamide is sourced from PubChem (CID 170078871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).