N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride

C15H27Cl2N5O2 — CID 119651623

IUPACN-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride
SMILESCNCC1CCCN1C(=O)CN(C)C(=O)C(C)n1cccn1.Cl.Cl
InChIInChI=1S/C15H25N5O2.2ClH/c1-12(20-9-5-7-17-20)15(22)18(3)11-14(21)19-8-4-6-13(19)10-16-2;;/h5,7,9,12-13,16H,4,6,8,10-11H2,1-3H3;2*1H
InChIKeyANNBHZAYTDXPEO-UHFFFAOYSA-N
MW380.32 g/mol
LogP0.96
Rot. Bonds6

About N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride

N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride (PubChem CID 119651623) has the molecular formula C15H27Cl2N5O2 and a molecular weight of 380.32 g/mol. Its IUPAC name is N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride.

Molecular Properties

Compound NameN-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride
PubChem CID119651623
Molecular FormulaC15H27Cl2N5O2
Molecular Weight380.32 g/mol
Exact Mass379.15
IUPAC NameN-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride
SMILESCNCC1CCCN1C(=O)CN(C)C(=O)C(C)n1cccn1.Cl.Cl
InChIInChI=1S/C15H25N5O2.2ClH/c1-12(20-9-5-7-17-20)15(22)18(3)11-14(21)19-8-4-6-13(19)10-16-2;;/h5,7,9,12-13,16H,4,6,8,10-11H2,1-3H3;2*1H
InChIKeyANNBHZAYTDXPEO-UHFFFAOYSA-N
XLogP0.96
TPSA70.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.32
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride 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

N-methyl-N-[2-[4-(methylaminomethyl)piperidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide
CID 119546336
N-[2-[2-[(3-fluorophenyl)methyl]pyrrolidin-1-yl]-2-oxoethyl]-N-methyl-2-pyrazol-1-ylpropanamide
CID 51124046
N-[2-(dicyclopropylmethylamino)-2-oxoethyl]-N-methyl-2-pyrazol-1-ylpropanamide
CID 87022204
N-methyl-N-[2-oxo-2-(piperidin-3-ylmethylamino)ethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride
CID 119463887
N-methyl-N-[2-[2-(1-methylimidazol-2-yl)piperazin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride
CID 120880497
N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]methanesulfonamide
CID 119650584
N-[2-[[2-(aminomethyl)cyclopentyl]amino]-2-oxoethyl]-N-methyl-2-pyrazol-1-ylpropanamide
CID 119604552
N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]ethanesulfonamide
CID 119649940
N-[2-[2-(3-fluorophenyl)piperazin-1-yl]-2-oxoethyl]-N-methyl-2-pyrazol-1-ylpropanamide;dihydrochloride
CID 120735854
N-methyl-N-[2-[methyl(piperidin-4-yl)amino]-2-oxoethyl]-2-pyrazol-1-ylpropanamide
CID 119444051
3-[methyl(2-pyrazol-1-ylpropanoyl)amino]propanoic acid
CID 60988614
1-[2-(methylaminomethyl)pyrrolidin-1-yl]-3-propan-2-yloxypropan-1-one;hydrochloride
CID 119649266

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride?
The IUPAC name of N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride (CID 119651623) is N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride.
What is the SMILES notation for N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride?
The canonical SMILES for N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride is CNCC1CCCN1C(=O)CN(C)C(=O)C(C)n1cccn1.Cl.Cl.
What is the InChIKey of N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride?
The InChIKey is ANNBHZAYTDXPEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O2.2ClH/c1-12(20-9-5-7-17-20)15(22)18(3)11-14(21)19-8-4-6-13(19)10-16-2;;/h5,7,9,12-13,16H,4,6,8,10-11H2,1-3H3;2*1H.
What are the key properties of N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride?
N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride has a molecular weight of 380.32 g/mol, XLogP of 0.96, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]-2-pyrazol-1-ylpropanamide;dihydrochloride is sourced from PubChem (CID 119651623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).