4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide

C24H25N7O2S — CID 69204361

IUPAC4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide
SMILESCn1cc(-c2cnc(N)c3c(C(=O)NC4CCN(C(=O)Nc5ccccc5)CC4)csc23)cn1
InChIInChI=1S/C24H25N7O2S/c1-30-13-15(11-27-30)18-12-26-22(25)20-19(14-34-21(18)20)23(32)28-17-7-9-31(10-8-17)24(33)29-16-5-3-2-4-6-16/h2-6,11-14,17H,7-10H2,1H3,(H2,25,26)(H,28,32)(H,29,33)
InChIKeyLZGSHTHVSLRJKU-UHFFFAOYSA-N
MW475.58 g/mol
LogP3.71
Rot. Bonds4

About 4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide

4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide (PubChem CID 69204361) has the molecular formula C24H25N7O2S and a molecular weight of 475.58 g/mol. Its IUPAC name is 4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide
PubChem CID69204361
Molecular FormulaC24H25N7O2S
Molecular Weight475.58 g/mol
Exact Mass475.18
IUPAC Name4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide
SMILESCn1cc(-c2cnc(N)c3c(C(=O)NC4CCN(C(=O)Nc5ccccc5)CC4)csc23)cn1
InChIInChI=1S/C24H25N7O2S/c1-30-13-15(11-27-30)18-12-26-22(25)20-19(14-34-21(18)20)23(32)28-17-7-9-31(10-8-17)24(33)29-16-5-3-2-4-6-16/h2-6,11-14,17H,7-10H2,1H3,(H2,25,26)(H,28,32)(H,29,33)
InChIKeyLZGSHTHVSLRJKU-UHFFFAOYSA-N
XLogP3.71
TPSA118.17 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500475.58
LogP ≤ 53.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

4-amino-N-[4-(cyclohexylcarbamoylamino)phenyl]-7-(1-methylpyrazol-4-yl)thieno[3,2-c]pyridine-3-carboxamide
CID 69179376
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CID 153439205
2-amino-N-[(3R)-1-[[3-(4-aminophenyl)phenyl]carbamoyl]pyrrolidin-3-yl]-5-(1-methylpyrazol-4-yl)pyridine-3-carboxamide
CID 142325437
2-amino-N-[(3R)-1-[(3-fluorophenyl)carbamoyl]pyrrolidin-3-yl]-5-(1-methylpyrazol-4-yl)pyridine-3-carboxamide
CID 142326172
2-amino-N-[(3R)-1-[[3-[4-(aminomethyl)phenyl]phenyl]carbamoyl]pyrrolidin-3-yl]-5-(1-methylpyrazol-4-yl)pyridine-3-carboxamide
CID 142325445
N-[1-(phenylcarbamoyl)piperidin-4-yl]-4-propylpyrimidine-5-carboxamide
CID 77094686
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2-amino-N-[(3R)-1-[[4-[3-(aminomethyl)phenyl]phenyl]carbamoyl]pyrrolidin-3-yl]-5-(1-methylpyrazol-4-yl)pyridine-3-carboxamide
CID 142326117
N-phenyl-4-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonylamino)piperidine-1-carboxamide
CID 51324355
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4-[(2-chlorobenzoyl)amino]-N-phenylpiperidine-1-carboxamide
CID 51324372
2-amino-5-(1-methylpyrazol-4-yl)-N-[(3R)-1-[(3,4,5-trimethoxyphenyl)carbamoyl]pyrrolidin-3-yl]pyridine-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide?
The IUPAC name of 4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide (CID 69204361) is 4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide.
What is the SMILES notation for 4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide?
The canonical SMILES for 4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide is Cn1cc(-c2cnc(N)c3c(C(=O)NC4CCN(C(=O)Nc5ccccc5)CC4)csc23)cn1.
What is the InChIKey of 4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide?
The InChIKey is LZGSHTHVSLRJKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N7O2S/c1-30-13-15(11-27-30)18-12-26-22(25)20-19(14-34-21(18)20)23(32)28-17-7-9-31(10-8-17)24(33)29-16-5-3-2-4-6-16/h2-6,11-14,17H,7-10H2,1H3,(H2,25,26)(H,28,32)(H,29,33).
What are the key properties of 4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide?
4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide has a molecular weight of 475.58 g/mol, XLogP of 3.71, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-7-(1-methylpyrazol-4-yl)-N-[1-(phenylcarbamoyl)piperidin-4-yl]thieno[3,2-c]pyridine-3-carboxamide is sourced from PubChem (CID 69204361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).