N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide

C14H29N3O — CID 55000406

IUPACN-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide
SMILESCC(C)CC(C)N(C)C(=O)C(C)N1CCNCC1
InChIInChI=1S/C14H29N3O/c1-11(2)10-12(3)16(5)14(18)13(4)17-8-6-15-7-9-17/h11-13,15H,6-10H2,1-5H3
InChIKeyINEBNVXFIBPROK-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.17
Rot. Bonds5

About N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide

N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide (PubChem CID 55000406) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide.

Molecular Properties

Compound NameN-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide
PubChem CID55000406
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC NameN-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide
SMILESCC(C)CC(C)N(C)C(=O)C(C)N1CCNCC1
InChIInChI=1S/C14H29N3O/c1-11(2)10-12(3)16(5)14(18)13(4)17-8-6-15-7-9-17/h11-13,15H,6-10H2,1-5H3
InChIKeyINEBNVXFIBPROK-UHFFFAOYSA-N
XLogP1.17
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(1-cyanopropan-2-yl)-N-methyl-2-piperazin-1-ylpropanamide
CID 55174159
(2R)-N,N-dimethyl-2-piperazin-1-ylpropanamide
CID 28906098
N-ethyl-N-(2-methylpropyl)-2-piperazin-1-ylpropanamide
CID 43274010
N-butyl-N-methyl-2-piperazin-1-ylpropanamide
CID 43130649
N-cyclopropyl-N-ethyl-2-piperazin-1-ylpropanamide
CID 43264445
4-methylpentan-2-yl 2-piperazin-1-ylpropanoate
CID 62310668
methyl 2-[methyl(2-piperazin-1-ylpropanoyl)amino]acetate
CID 43130551
N-[1-(4-chlorophenyl)ethyl]-N-methyl-2-piperazin-1-ylpropanamide
CID 62979413
N-(2-hydroxyethyl)-2-piperazin-1-yl-N-propan-2-ylpropanamide
CID 54995362
N-(2-ethoxyethyl)-N-ethyl-2-piperazin-1-ylpropanamide
CID 63691474
N-butyl-N-cyclopropyl-2-piperazin-1-ylpropanamide
CID 61442974
N-[2-(methylamino)-2-oxoethyl]-2-piperazin-1-yl-N-propylpropanamide
CID 54985265

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide?
The IUPAC name of N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide (CID 55000406) is N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide.
What is the SMILES notation for N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide?
The canonical SMILES for N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide is CC(C)CC(C)N(C)C(=O)C(C)N1CCNCC1.
What is the InChIKey of N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide?
The InChIKey is INEBNVXFIBPROK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-11(2)10-12(3)16(5)14(18)13(4)17-8-6-15-7-9-17/h11-13,15H,6-10H2,1-5H3.
What are the key properties of N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide?
N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide has a molecular weight of 255.41 g/mol, XLogP of 1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4-methylpentan-2-yl)-2-piperazin-1-ylpropanamide is sourced from PubChem (CID 55000406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).