2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide

C10H21N5O2 — CID 43252611

IUPAC2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide
SMILESCC(C(=O)NC(N)=O)N1CCN(CCN)CC1
InChIInChI=1S/C10H21N5O2/c1-8(9(16)13-10(12)17)15-6-4-14(3-2-11)5-7-15/h8H,2-7,11H2,1H3,(H3,12,13,16,17)
InChIKeyDFRIPZULVAZWJZ-UHFFFAOYSA-N
MW243.31 g/mol
LogP-1.85
Rot. Bonds4

About 2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide

2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide (PubChem CID 43252611) has the molecular formula C10H21N5O2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide.

Molecular Properties

Compound Name2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide
PubChem CID43252611
Molecular FormulaC10H21N5O2
Molecular Weight243.31 g/mol
Exact Mass243.17
IUPAC Name2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide
SMILESCC(C(=O)NC(N)=O)N1CCN(CCN)CC1
InChIInChI=1S/C10H21N5O2/c1-8(9(16)13-10(12)17)15-6-4-14(3-2-11)5-7-15/h8H,2-7,11H2,1H3,(H3,12,13,16,17)
InChIKeyDFRIPZULVAZWJZ-UHFFFAOYSA-N
XLogP-1.85
TPSA104.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 5-1.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide 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

2-[4-(1-aminopropan-2-yl)piperazin-1-yl]-N-carbamoylpropanamide
CID 63339692
2,4-bis[4-(2-aminoethyl)piperazin-1-yl]pentan-3-one
CID 151041941
N-carbamoyl-2-[4-(cyanomethyl)piperazin-1-yl]propanamide
CID 55201574
2-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-N-(ethylcarbamoyl)propanamide
CID 43252708
2-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-N-(2-methylpropyl)propanamide
CID 43252717
2-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-N-cyclopropylpropanamide
CID 43252701
(2R)-N-carbamoyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide
CID 32721522
2-[4-(2-aminoethyl)piperazin-1-yl]-N,N-dimethylpropanamide
CID 43252622
2-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-N-butylpropanamide
CID 43252705
N-carbamoyl-2-[4-[2-(dimethylamino)-2-oxoethyl]-1,4-diazepan-1-yl]propanamide
CID 46444317
2-[4-(2-aminoethyl)-1,4-diazepan-1-yl]-N-(2-methoxyethyl)propanamide
CID 43252719
2-[4-(2-aminoethoxy)piperidin-1-yl]-N-carbamoylpropanamide
CID 82692623

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide?
The IUPAC name of 2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide (CID 43252611) is 2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide.
What is the SMILES notation for 2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide?
The canonical SMILES for 2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide is CC(C(=O)NC(N)=O)N1CCN(CCN)CC1.
What is the InChIKey of 2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide?
The InChIKey is DFRIPZULVAZWJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N5O2/c1-8(9(16)13-10(12)17)15-6-4-14(3-2-11)5-7-15/h8H,2-7,11H2,1H3,(H3,12,13,16,17).
What are the key properties of 2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide?
2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide has a molecular weight of 243.31 g/mol, XLogP of -1.85, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-aminoethyl)piperazin-1-yl]-N-carbamoylpropanamide is sourced from PubChem (CID 43252611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).