N,N,1-trimethylpyrazolidine-3-carboxamide

C7H15N3O — CID 20786329

IUPACN,N,1-trimethylpyrazolidine-3-carboxamide
SMILESCN1CCC(C(=O)N(C)C)N1
InChIInChI=1S/C7H15N3O/c1-9(2)7(11)6-4-5-10(3)8-6/h6,8H,4-5H2,1-3H3
InChIKeyNMFXQLWBYZTNGX-UHFFFAOYSA-N
MW157.22 g/mol
LogP-0.72
Rot. Bonds1

About N,N,1-trimethylpyrazolidine-3-carboxamide

N,N,1-trimethylpyrazolidine-3-carboxamide (PubChem CID 20786329) has the molecular formula C7H15N3O and a molecular weight of 157.22 g/mol. Its IUPAC name is N,N,1-trimethylpyrazolidine-3-carboxamide.

Molecular Properties

Compound NameN,N,1-trimethylpyrazolidine-3-carboxamide
PubChem CID20786329
Molecular FormulaC7H15N3O
Molecular Weight157.22 g/mol
Exact Mass157.12
IUPAC NameN,N,1-trimethylpyrazolidine-3-carboxamide
SMILESCN1CCC(C(=O)N(C)C)N1
InChIInChI=1S/C7H15N3O/c1-9(2)7(11)6-4-5-10(3)8-6/h6,8H,4-5H2,1-3H3
InChIKeyNMFXQLWBYZTNGX-UHFFFAOYSA-N
XLogP-0.72
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 5-0.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N,1-trimethylpyrazolidine-3-carboxamide?
The IUPAC name of N,N,1-trimethylpyrazolidine-3-carboxamide (CID 20786329) is N,N,1-trimethylpyrazolidine-3-carboxamide.
What is the SMILES notation for N,N,1-trimethylpyrazolidine-3-carboxamide?
The canonical SMILES for N,N,1-trimethylpyrazolidine-3-carboxamide is CN1CCC(C(=O)N(C)C)N1.
What is the InChIKey of N,N,1-trimethylpyrazolidine-3-carboxamide?
The InChIKey is NMFXQLWBYZTNGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O/c1-9(2)7(11)6-4-5-10(3)8-6/h6,8H,4-5H2,1-3H3.
What are the key properties of N,N,1-trimethylpyrazolidine-3-carboxamide?
N,N,1-trimethylpyrazolidine-3-carboxamide has a molecular weight of 157.22 g/mol, XLogP of -0.72, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,1-trimethylpyrazolidine-3-carboxamide is sourced from PubChem (CID 20786329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).