4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide

C11H24N4O — CID 66427753

IUPAC4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide
SMILESCC(C)N1CCN(C(CN)CC(N)=O)CC1
InChIInChI=1S/C11H24N4O/c1-9(2)14-3-5-15(6-4-14)10(8-12)7-11(13)16/h9-10H,3-8,12H2,1-2H3,(H2,13,16)
InChIKeyHGYFTYRWJFAXTA-UHFFFAOYSA-N
MW228.34 g/mol
LogP-0.78
Rot. Bonds5

About 4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide

4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide (PubChem CID 66427753) has the molecular formula C11H24N4O and a molecular weight of 228.34 g/mol. Its IUPAC name is 4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide.

Molecular Properties

Compound Name4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide
PubChem CID66427753
Molecular FormulaC11H24N4O
Molecular Weight228.34 g/mol
Exact Mass228.20
IUPAC Name4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide
SMILESCC(C)N1CCN(C(CN)CC(N)=O)CC1
InChIInChI=1S/C11H24N4O/c1-9(2)14-3-5-15(6-4-14)10(8-12)7-11(13)16/h9-10H,3-8,12H2,1-2H3,(H2,13,16)
InChIKeyHGYFTYRWJFAXTA-UHFFFAOYSA-N
XLogP-0.78
TPSA75.59 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 ≤ 5-0.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-propan-2-yl-3-(4-propan-2-ylpiperazin-1-yl)butanamide
CID 66430565
4-amino-3-(4-tert-butylpiperidin-1-yl)butanamide
CID 66426477
4-amino-3-(4-propan-2-ylazepan-1-yl)butanamide
CID 66426900
4-amino-3-(3-azaspiro[5.5]undecan-3-yl)butanamide
CID 66427333
4-methyl-2-(4-propan-2-ylpiperazin-1-yl)pentan-1-amine
CID 43585175
4-amino-3-(4-butan-2-ylpiperazin-1-yl)-N-propan-2-ylbutanamide
CID 66431392
3-[(1-propan-2-ylpiperidin-4-yl)amino]butanamide
CID 115572761
4-amino-3-(2-methylpyrrolidin-1-yl)butanamide
CID 66428386
4-amino-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)butanamide
CID 66427970
4-amino-3-(2-methylpiperidin-1-yl)butanamide
CID 66426676
1-[4-(1-aminobutan-2-yl)piperazin-1-yl]-2-methylpropan-1-one
CID 63341069
3-amino-1-(4-propan-2-ylpiperazin-1-yl)propan-1-one
CID 2756459

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide?
The IUPAC name of 4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide (CID 66427753) is 4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide.
What is the SMILES notation for 4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide?
The canonical SMILES for 4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide is CC(C)N1CCN(C(CN)CC(N)=O)CC1.
What is the InChIKey of 4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide?
The InChIKey is HGYFTYRWJFAXTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O/c1-9(2)14-3-5-15(6-4-14)10(8-12)7-11(13)16/h9-10H,3-8,12H2,1-2H3,(H2,13,16).
What are the key properties of 4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide?
4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide has a molecular weight of 228.34 g/mol, XLogP of -0.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-(4-propan-2-ylpiperazin-1-yl)butanamide is sourced from PubChem (CID 66427753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).