1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide

C24H29N7O — CID 153404030

IUPAC1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide
SMILESCc1nc(N2CC3CC3C2C)ccc1Cn1cc(C(=O)NC2CCc3c2n[nH]c3C)cn1
InChIInChI=1S/C24H29N7O/c1-13-16(4-7-22(26-13)31-12-17-8-20(17)15(31)3)10-30-11-18(9-25-30)24(32)27-21-6-5-19-14(2)28-29-23(19)21/h4,7,9,11,15,17,20-21H,5-6,8,10,12H2,1-3H3,(H,27,32)(H,28,29)
InChIKeyAFXHICVYZKROGR-UHFFFAOYSA-N
MW431.54 g/mol
LogP2.93
Rot. Bonds5

About 1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide

1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide (PubChem CID 153404030) has the molecular formula C24H29N7O and a molecular weight of 431.54 g/mol. Its IUPAC name is 1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide
PubChem CID153404030
Molecular FormulaC24H29N7O
Molecular Weight431.54 g/mol
Exact Mass431.24
IUPAC Name1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide
SMILESCc1nc(N2CC3CC3C2C)ccc1Cn1cc(C(=O)NC2CCc3c2n[nH]c3C)cn1
InChIInChI=1S/C24H29N7O/c1-13-16(4-7-22(26-13)31-12-17-8-20(17)15(31)3)10-30-11-18(9-25-30)24(32)27-21-6-5-19-14(2)28-29-23(19)21/h4,7,9,11,15,17,20-21H,5-6,8,10,12H2,1-3H3,(H,27,32)(H,28,29)
InChIKeyAFXHICVYZKROGR-UHFFFAOYSA-N
XLogP2.93
TPSA91.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.54
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide?
The IUPAC name of 1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide (CID 153404030) is 1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide.
What is the SMILES notation for 1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide?
The canonical SMILES for 1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide is Cc1nc(N2CC3CC3C2C)ccc1Cn1cc(C(=O)NC2CCc3c2n[nH]c3C)cn1.
What is the InChIKey of 1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide?
The InChIKey is AFXHICVYZKROGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N7O/c1-13-16(4-7-22(26-13)31-12-17-8-20(17)15(31)3)10-30-11-18(9-25-30)24(32)27-21-6-5-19-14(2)28-29-23(19)21/h4,7,9,11,15,17,20-21H,5-6,8,10,12H2,1-3H3,(H,27,32)(H,28,29).
What are the key properties of 1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide?
1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide has a molecular weight of 431.54 g/mol, XLogP of 2.93, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-methyl-6-(2-methyl-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methyl]-N-(3-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-6-yl)pyrazole-4-carboxamide is sourced from PubChem (CID 153404030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).