3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide

C11H23N3O — CID 62671402

IUPAC3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCN1CCNCC1C
InChIInChI=1S/C11H23N3O/c1-9(2)13-11(15)4-6-14-7-5-12-8-10(14)3/h9-10,12H,4-8H2,1-3H3,(H,13,15)
InChIKeyLTMMZMGRYAAFPF-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.19
Rot. Bonds4

About 3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide

3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide (PubChem CID 62671402) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide
PubChem CID62671402
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCN1CCNCC1C
InChIInChI=1S/C11H23N3O/c1-9(2)13-11(15)4-6-14-7-5-12-8-10(14)3/h9-10,12H,4-8H2,1-3H3,(H,13,15)
InChIKeyLTMMZMGRYAAFPF-UHFFFAOYSA-N
XLogP0.19
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2,5-dimethylpiperazin-1-yl)-N-propan-2-ylpropanamide
CID 64980409
(2S)-2-methyl-N-propan-2-ylpiperazine-1-carboxamide
CID 82756259
N-(5-methyl-1,2-oxazol-3-yl)-3-(2-methylpiperazin-1-yl)propanamide
CID 62672823
N-methyl-2-(2-methylpiperazin-1-yl)acetamide
CID 62674057
2-methyl-1-(4-propan-2-yloxybutyl)piperazine
CID 106008832
N-(3-cyanothiophen-2-yl)-3-[(2R)-2-methylpiperazin-1-yl]propanamide
CID 82761956
methyl 2-methyl-3-[(2R)-2-methylpiperazin-1-yl]propanoate
CID 82760949
2-methyl-1-(2-methylsulfonylethyl)piperazine
CID 62674203
2-methyl-1-(4-methylpentyl)piperazine
CID 64931123
N-(2,5-dichlorophenyl)-3-(2-methylpiperazin-1-yl)propanamide;hydrochloride
CID 119916621
(2R)-1-(2-fluoroethyl)-2-methylpiperazine
CID 82761196
2-[(2S)-2-methylpiperazin-1-yl]-N,N-di(propan-2-yl)acetamide
CID 82705954

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide?
The IUPAC name of 3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide (CID 62671402) is 3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide?
The canonical SMILES for 3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide is CC(C)NC(=O)CCN1CCNCC1C.
What is the InChIKey of 3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide?
The InChIKey is LTMMZMGRYAAFPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-9(2)13-11(15)4-6-14-7-5-12-8-10(14)3/h9-10,12H,4-8H2,1-3H3,(H,13,15).
What are the key properties of 3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide?
3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide has a molecular weight of 213.32 g/mol, XLogP of 0.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpiperazin-1-yl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 62671402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).