N-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide

C14H28N4O — CID 134514962

IUPACN-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide
SMILESCN(C)CC1(NC(=O)N2CCCC2)CCN(C)CC1
InChIInChI=1S/C14H28N4O/c1-16(2)12-14(6-10-17(3)11-7-14)15-13(19)18-8-4-5-9-18/h4-12H2,1-3H3,(H,15,19)
InChIKeyHBAFCLZZZGHNCV-UHFFFAOYSA-N
MW268.40 g/mol
LogP0.82
Rot. Bonds3

About N-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide

N-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide (PubChem CID 134514962) has the molecular formula C14H28N4O and a molecular weight of 268.40 g/mol. Its IUPAC name is N-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide
PubChem CID134514962
Molecular FormulaC14H28N4O
Molecular Weight268.40 g/mol
Exact Mass268.23
IUPAC NameN-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide
SMILESCN(C)CC1(NC(=O)N2CCCC2)CCN(C)CC1
InChIInChI=1S/C14H28N4O/c1-16(2)12-14(6-10-17(3)11-7-14)15-13(19)18-8-4-5-9-18/h4-12H2,1-3H3,(H,15,19)
InChIKeyHBAFCLZZZGHNCV-UHFFFAOYSA-N
XLogP0.82
TPSA38.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide (CID 134514962) is N-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide is CN(C)CC1(NC(=O)N2CCCC2)CCN(C)CC1.
What is the InChIKey of N-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide?
The InChIKey is HBAFCLZZZGHNCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O/c1-16(2)12-14(6-10-17(3)11-7-14)15-13(19)18-8-4-5-9-18/h4-12H2,1-3H3,(H,15,19).
What are the key properties of N-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide?
N-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide has a molecular weight of 268.40 g/mol, XLogP of 0.82, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(dimethylamino)methyl]-1-methylpiperidin-4-yl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 134514962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).