N-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol

C20H32N4O2 — CID 145397701

IUPACN-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol
SMILESCC(C)CO.CNc1cc(C)n2ccc(C(=O)NC3CCCCC3)c2n1
InChIInChI=1S/C16H22N4O.C4H10O/c1-11-10-14(17-2)19-15-13(8-9-20(11)15)16(21)18-12-6-4-3-5-7-12;1-4(2)3-5/h8-10,12H,3-7H2,1-2H3,(H,17,19)(H,18,21);4-5H,3H2,1-2H3
InChIKeyDZBWSECSFAXZEA-UHFFFAOYSA-N
MW360.50 g/mol
LogP3.38
Rot. Bonds4

About N-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol

N-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol (PubChem CID 145397701) has the molecular formula C20H32N4O2 and a molecular weight of 360.50 g/mol. Its IUPAC name is N-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol.

Molecular Properties

Compound NameN-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol
PubChem CID145397701
Molecular FormulaC20H32N4O2
Molecular Weight360.50 g/mol
Exact Mass360.25
IUPAC NameN-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol
SMILESCC(C)CO.CNc1cc(C)n2ccc(C(=O)NC3CCCCC3)c2n1
InChIInChI=1S/C16H22N4O.C4H10O/c1-11-10-14(17-2)19-15-13(8-9-20(11)15)16(21)18-12-6-4-3-5-7-12;1-4(2)3-5/h8-10,12H,3-7H2,1-2H3,(H,17,19)(H,18,21);4-5H,3H2,1-2H3
InChIKeyDZBWSECSFAXZEA-UHFFFAOYSA-N
XLogP3.38
TPSA78.66 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.50
LogP ≤ 53.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol 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-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol?
The IUPAC name of N-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol (CID 145397701) is N-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol.
What is the SMILES notation for N-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol?
The canonical SMILES for N-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol is CC(C)CO.CNc1cc(C)n2ccc(C(=O)NC3CCCCC3)c2n1.
What is the InChIKey of N-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol?
The InChIKey is DZBWSECSFAXZEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O.C4H10O/c1-11-10-14(17-2)19-15-13(8-9-20(11)15)16(21)18-12-6-4-3-5-7-12;1-4(2)3-5/h8-10,12H,3-7H2,1-2H3,(H,17,19)(H,18,21);4-5H,3H2,1-2H3.
What are the key properties of N-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol?
N-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol has a molecular weight of 360.50 g/mol, XLogP of 3.38, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-methyl-2-(methylamino)pyrrolo[1,2-a]pyrimidine-8-carboxamide;2-methylpropan-1-ol is sourced from PubChem (CID 145397701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).