1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide

C19H24N8O — CID 90183655

IUPAC1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide
SMILESCc1nc2cnc(Nc3ccnc(NCC4(C(N)=O)CC4)n3)cc2n1C(C)C
InChIInChI=1S/C19H24N8O/c1-11(2)27-12(3)24-13-9-22-16(8-14(13)27)25-15-4-7-21-18(26-15)23-10-19(5-6-19)17(20)28/h4,7-9,11H,5-6,10H2,1-3H3,(H2,20,28)(H2,21,22,23,25,26)
InChIKeyLCFGLJKQRCLUQH-UHFFFAOYSA-N
MW380.46 g/mol
LogP2.53
Rot. Bonds7

About 1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide

1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide (PubChem CID 90183655) has the molecular formula C19H24N8O and a molecular weight of 380.46 g/mol. Its IUPAC name is 1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide
PubChem CID90183655
Molecular FormulaC19H24N8O
Molecular Weight380.46 g/mol
Exact Mass380.21
IUPAC Name1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide
SMILESCc1nc2cnc(Nc3ccnc(NCC4(C(N)=O)CC4)n3)cc2n1C(C)C
InChIInChI=1S/C19H24N8O/c1-11(2)27-12(3)24-13-9-22-16(8-14(13)27)25-15-4-7-21-18(26-15)23-10-19(5-6-19)17(20)28/h4,7-9,11H,5-6,10H2,1-3H3,(H2,20,28)(H2,21,22,23,25,26)
InChIKeyLCFGLJKQRCLUQH-UHFFFAOYSA-N
XLogP2.53
TPSA123.64 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.46
LogP ≤ 52.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze 1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide 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 1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide?
The IUPAC name of 1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide (CID 90183655) is 1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide.
What is the SMILES notation for 1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide?
The canonical SMILES for 1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide is Cc1nc2cnc(Nc3ccnc(NCC4(C(N)=O)CC4)n3)cc2n1C(C)C.
What is the InChIKey of 1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide?
The InChIKey is LCFGLJKQRCLUQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N8O/c1-11(2)27-12(3)24-13-9-22-16(8-14(13)27)25-15-4-7-21-18(26-15)23-10-19(5-6-19)17(20)28/h4,7-9,11H,5-6,10H2,1-3H3,(H2,20,28)(H2,21,22,23,25,26).
What are the key properties of 1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide?
1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide has a molecular weight of 380.46 g/mol, XLogP of 2.53, 7 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[4-[(2-methyl-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)amino]pyrimidin-2-yl]amino]methyl]cyclopropane-1-carboxamide is sourced from PubChem (CID 90183655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).