2-piperazin-1-yl-N-propan-2-ylpropanamide

C10H21N3O — CID 13454833

IUPAC2-piperazin-1-yl-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)N1CCNCC1
InChIInChI=1S/C10H21N3O/c1-8(2)12-10(14)9(3)13-6-4-11-5-7-13/h8-9,11H,4-7H2,1-3H3,(H,12,14)
InChIKeyVMGKQRQGNUCHLD-UHFFFAOYSA-N
MW199.30 g/mol
LogP-0.20
Rot. Bonds3

About 2-piperazin-1-yl-N-propan-2-ylpropanamide

2-piperazin-1-yl-N-propan-2-ylpropanamide (PubChem CID 13454833) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 2-piperazin-1-yl-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-piperazin-1-yl-N-propan-2-ylpropanamide
PubChem CID13454833
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name2-piperazin-1-yl-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)N1CCNCC1
InChIInChI=1S/C10H21N3O/c1-8(2)12-10(14)9(3)13-6-4-11-5-7-13/h8-9,11H,4-7H2,1-3H3,(H,12,14)
InChIKeyVMGKQRQGNUCHLD-UHFFFAOYSA-N
XLogP-0.20
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,6-Dimethylpiperazine-2,5-dione
CID 97704
2-Piperazinone, 3,3-dimethyl-
CID 211157
N,N-dimethyl-2-(piperazin-1-yl)acetamide
CID 2758642
Cyclo(alanyl-glycyl)
CID 107297
Cyclo(alanylalanyl)
CID 165356
N-isopropyl-1-piperazineacetamide
CID 100826
L-Alanylglycinamide
CID 7019037
N-[2-(4-propanoylpiperazin-1-yl)ethyl]propanamide
CID 718529
(3S,6S)-3,6-Diisopropylpiperazine-2,5-dione
CID 7075896
Alanine anhydride, trans-(A+-)-
CID 676438
1-(Piperazin-1-yl)propan-1-one
CID 3844375
3-Ethylpiperazin-2-one
CID 4712457

Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-yl-N-propan-2-ylpropanamide?
The IUPAC name of 2-piperazin-1-yl-N-propan-2-ylpropanamide (CID 13454833) is 2-piperazin-1-yl-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-piperazin-1-yl-N-propan-2-ylpropanamide?
The canonical SMILES for 2-piperazin-1-yl-N-propan-2-ylpropanamide is CC(C)NC(=O)C(C)N1CCNCC1.
What is the InChIKey of 2-piperazin-1-yl-N-propan-2-ylpropanamide?
The InChIKey is VMGKQRQGNUCHLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-8(2)12-10(14)9(3)13-6-4-11-5-7-13/h8-9,11H,4-7H2,1-3H3,(H,12,14).
What are the key properties of 2-piperazin-1-yl-N-propan-2-ylpropanamide?
2-piperazin-1-yl-N-propan-2-ylpropanamide has a molecular weight of 199.30 g/mol, XLogP of -0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-yl-N-propan-2-ylpropanamide is sourced from PubChem (CID 13454833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).