N,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide

C14H29N3O — CID 82245449

IUPACN,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide
SMILESCC(C)CC1CNC(C(C)C)CN1C(=O)N(C)C
InChIInChI=1S/C14H29N3O/c1-10(2)7-12-8-15-13(11(3)4)9-17(12)14(18)16(5)6/h10-13,15H,7-9H2,1-6H3
InChIKeyJROFNBDLSYWXAE-UHFFFAOYSA-N
MW255.41 g/mol
LogP2.01
Rot. Bonds3

About N,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide

N,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide (PubChem CID 82245449) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is N,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide
PubChem CID82245449
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC NameN,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide
SMILESCC(C)CC1CNC(C(C)C)CN1C(=O)N(C)C
InChIInChI=1S/C14H29N3O/c1-10(2)7-12-8-15-13(11(3)4)9-17(12)14(18)16(5)6/h10-13,15H,7-9H2,1-6H3
InChIKeyJROFNBDLSYWXAE-UHFFFAOYSA-N
XLogP2.01
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-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,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide?
The IUPAC name of N,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide (CID 82245449) is N,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide.
What is the SMILES notation for N,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide?
The canonical SMILES for N,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide is CC(C)CC1CNC(C(C)C)CN1C(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide?
The InChIKey is JROFNBDLSYWXAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-10(2)7-12-8-15-13(11(3)4)9-17(12)14(18)16(5)6/h10-13,15H,7-9H2,1-6H3.
What are the key properties of N,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide?
N,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide has a molecular weight of 255.41 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(2-methylpropyl)-5-propan-2-ylpiperazine-1-carboxamide is sourced from PubChem (CID 82245449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).