N-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide

C11H24N4O — CID 83022308

IUPACN-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide
SMILESCCC(C)NC(=O)CNN1CCN(C)CC1
InChIInChI=1S/C11H24N4O/c1-4-10(2)13-11(16)9-12-15-7-5-14(3)6-8-15/h10,12H,4-9H2,1-3H3,(H,13,16)
InChIKeyKGFDIQQPUHFKFG-UHFFFAOYSA-N
MW228.34 g/mol
LogP-0.35
Rot. Bonds5

About N-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide

N-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide (PubChem CID 83022308) has the molecular formula C11H24N4O and a molecular weight of 228.34 g/mol. Its IUPAC name is N-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide
PubChem CID83022308
Molecular FormulaC11H24N4O
Molecular Weight228.34 g/mol
Exact Mass228.20
IUPAC NameN-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide
SMILESCCC(C)NC(=O)CNN1CCN(C)CC1
InChIInChI=1S/C11H24N4O/c1-4-10(2)13-11(16)9-12-15-7-5-14(3)6-8-15/h10,12H,4-9H2,1-3H3,(H,13,16)
InChIKeyKGFDIQQPUHFKFG-UHFFFAOYSA-N
XLogP-0.35
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methylbutan-2-yl)-2-[(4-methylpiperazin-1-yl)amino]acetamide
CID 83021138
ethyl 2-[[2-(butan-2-ylamino)-2-oxoethyl]amino]acetate
CID 60811242
2-[[(4-methylpiperazin-1-yl)amino]methyl]prop-2-enoic acid
CID 103261245
3-[3-(4-methylpiperazin-1-yl)propanoylamino]butanoic acid
CID 110834607
N-butan-2-yl-3-[4-(4-methylpiperazin-1-yl)anilino]propanamide
CID 109013029
N-butan-2-yl-2-[[2-(tert-butylamino)-2-oxoethyl]amino]acetamide
CID 113219551
4-methyl-N-(2-methylprop-2-enyl)piperazin-1-amine
CID 83021456
N-butan-2-yl-2-(3-methylpentan-2-ylamino)acetamide
CID 61463687
N-butan-2-yl-2-(2,2-dimethylbutylamino)acetamide
CID 103461294
N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide
CID 43180189
N-butan-2-yl-2-(octylamino)acetamide
CID 78914360
N-butan-2-yl-3-(2,3-dihydroindol-1-yl)propanamide
CID 109012970

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide?
The IUPAC name of N-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide (CID 83022308) is N-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide.
What is the SMILES notation for N-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide?
The canonical SMILES for N-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide is CCC(C)NC(=O)CNN1CCN(C)CC1.
What is the InChIKey of N-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide?
The InChIKey is KGFDIQQPUHFKFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O/c1-4-10(2)13-11(16)9-12-15-7-5-14(3)6-8-15/h10,12H,4-9H2,1-3H3,(H,13,16).
What are the key properties of N-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide?
N-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide has a molecular weight of 228.34 g/mol, XLogP of -0.35, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[(4-methylpiperazin-1-yl)amino]acetamide is sourced from PubChem (CID 83022308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).