N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide

C24H29N7O4 — CID 154654464

IUPACN-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide
SMILESCC(C)Oc1cncc(C(=O)Nc2cn[nH]c2C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)c1
InChIInChI=1S/C24H29N7O4/c1-15(2)34-19-10-16(11-25-13-19)23(32)29-20-14-27-30-22(20)24(33)28-17-4-5-21(26-12-17)35-18-6-8-31(3)9-7-18/h4-5,10-15,18H,6-9H2,1-3H3,(H,27,30)(H,28,33)(H,29,32)
InChIKeyYXILMKSTKWCDIJ-UHFFFAOYSA-N
MW479.54 g/mol
LogP2.96
Rot. Bonds8

About N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide

N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide (PubChem CID 154654464) has the molecular formula C24H29N7O4 and a molecular weight of 479.54 g/mol. Its IUPAC name is N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide
PubChem CID154654464
Molecular FormulaC24H29N7O4
Molecular Weight479.54 g/mol
Exact Mass479.23
IUPAC NameN-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide
SMILESCC(C)Oc1cncc(C(=O)Nc2cn[nH]c2C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)c1
InChIInChI=1S/C24H29N7O4/c1-15(2)34-19-10-16(11-25-13-19)23(32)29-20-14-27-30-22(20)24(33)28-17-4-5-21(26-12-17)35-18-6-8-31(3)9-7-18/h4-5,10-15,18H,6-9H2,1-3H3,(H,27,30)(H,28,33)(H,29,32)
InChIKeyYXILMKSTKWCDIJ-UHFFFAOYSA-N
XLogP2.96
TPSA134.36 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500479.54
LogP ≤ 52.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-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 N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide?
The IUPAC name of N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide (CID 154654464) is N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide.
What is the SMILES notation for N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide?
The canonical SMILES for N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide is CC(C)Oc1cncc(C(=O)Nc2cn[nH]c2C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)c1.
What is the InChIKey of N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide?
The InChIKey is YXILMKSTKWCDIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N7O4/c1-15(2)34-19-10-16(11-25-13-19)23(32)29-20-14-27-30-22(20)24(33)28-17-4-5-21(26-12-17)35-18-6-8-31(3)9-7-18/h4-5,10-15,18H,6-9H2,1-3H3,(H,27,30)(H,28,33)(H,29,32).
What are the key properties of N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide?
N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide has a molecular weight of 479.54 g/mol, XLogP of 2.96, 8 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-propan-2-yloxypyridine-3-carboxamide is sourced from PubChem (CID 154654464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).