N-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid

C19H30F3N5O3 — CID 118745401

IUPACN-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid
SMILESCC(C)N(C)Cc1cnc2n1CCN(C(=O)NC1CCCC1)C2.O=C(O)C(F)(F)F
InChIInChI=1S/C17H29N5O.C2HF3O2/c1-13(2)20(3)11-15-10-18-16-12-21(8-9-22(15)16)17(23)19-14-6-4-5-7-14;3-2(4,5)1(6)7/h10,13-14H,4-9,11-12H2,1-3H3,(H,19,23);(H,6,7)
InChIKeyCGAMWQPKGZLATL-UHFFFAOYSA-N
MW433.48 g/mol
LogP2.82
Rot. Bonds4

About N-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid

N-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid (PubChem CID 118745401) has the molecular formula C19H30F3N5O3 and a molecular weight of 433.48 g/mol. Its IUPAC name is N-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid.

Molecular Properties

Compound NameN-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid
PubChem CID118745401
Molecular FormulaC19H30F3N5O3
Molecular Weight433.48 g/mol
Exact Mass433.23
IUPAC NameN-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid
SMILESCC(C)N(C)Cc1cnc2n1CCN(C(=O)NC1CCCC1)C2.O=C(O)C(F)(F)F
InChIInChI=1S/C17H29N5O.C2HF3O2/c1-13(2)20(3)11-15-10-18-16-12-21(8-9-22(15)16)17(23)19-14-6-4-5-7-14;3-2(4,5)1(6)7/h10,13-14H,4-9,11-12H2,1-3H3,(H,19,23);(H,6,7)
InChIKeyCGAMWQPKGZLATL-UHFFFAOYSA-N
XLogP2.82
TPSA90.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.48
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid?
The IUPAC name of N-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid (CID 118745401) is N-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid.
What is the SMILES notation for N-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid?
The canonical SMILES for N-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid is CC(C)N(C)Cc1cnc2n1CCN(C(=O)NC1CCCC1)C2.O=C(O)C(F)(F)F.
What is the InChIKey of N-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid?
The InChIKey is CGAMWQPKGZLATL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N5O.C2HF3O2/c1-13(2)20(3)11-15-10-18-16-12-21(8-9-22(15)16)17(23)19-14-6-4-5-7-14;3-2(4,5)1(6)7/h10,13-14H,4-9,11-12H2,1-3H3,(H,19,23);(H,6,7).
What are the key properties of N-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid?
N-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid has a molecular weight of 433.48 g/mol, XLogP of 2.82, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-[[methyl(propan-2-yl)amino]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carboxamide;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 118745401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).