N,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide

C24H33N7O3 — CID 135750802

IUPACN,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide
SMILESCCN(CC)C(=O)N1CCc2[nH]nc(-c3nc4ccc(OCCN5CCOCC5)cc4[nH]3)c2C1
InChIInChI=1S/C24H33N7O3/c1-3-30(4-2)24(32)31-8-7-19-18(16-31)22(28-27-19)23-25-20-6-5-17(15-21(20)26-23)34-14-11-29-9-12-33-13-10-29/h5-6,15H,3-4,7-14,16H2,1-2H3,(H,25,26)(H,27,28)
InChIKeyAPYYIQSMKFHADA-UHFFFAOYSA-N
MW467.57 g/mol
LogP2.48
Rot. Bonds7

About N,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide

N,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide (PubChem CID 135750802) has the molecular formula C24H33N7O3 and a molecular weight of 467.57 g/mol. Its IUPAC name is N,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide
PubChem CID135750802
Molecular FormulaC24H33N7O3
Molecular Weight467.57 g/mol
Exact Mass467.26
IUPAC NameN,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide
SMILESCCN(CC)C(=O)N1CCc2[nH]nc(-c3nc4ccc(OCCN5CCOCC5)cc4[nH]3)c2C1
InChIInChI=1S/C24H33N7O3/c1-3-30(4-2)24(32)31-8-7-19-18(16-31)22(28-27-19)23-25-20-6-5-17(15-21(20)26-23)34-14-11-29-9-12-33-13-10-29/h5-6,15H,3-4,7-14,16H2,1-2H3,(H,25,26)(H,27,28)
InChIKeyAPYYIQSMKFHADA-UHFFFAOYSA-N
XLogP2.48
TPSA102.61 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.57
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-hydroxy-2-[4-(2-morpholin-4-ylethoxy)phenyl]-3H-benzimidazole-5-carboxamide
CID 122690240
4-[2-[[2-(3-methyl-4-pyridinyl)-3H-benzimidazol-5-yl]oxy]ethyl]morpholine
CID 153469808
[4-[2-[[6-(6-methyl-1H-benzimidazol-2-yl)-3-pyridinyl]oxy]ethyl]piperazin-1-yl]-phenylmethanone
CID 130317673
ethyl 5-(2-morpholin-4-ylethoxy)-1H-indole-2-carboxylate
CID 11623861
4-[2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]ethyl]morpholine;dihydrochloride
CID 11349505
2-[2-methyl-4-(2-morpholin-4-ylethoxy)phenyl]-1H-benzimidazole-4-carboxylic acid
CID 58279088
2-(6-chloro-1H-indazol-3-yl)-6-(3-pyrrolidin-1-ylpropoxy)-1H-benzimidazole
CID 135820300
ethane;3-[6-(2-piperidin-1-ylethoxy)-1H-benzimidazol-2-yl]-1H-quinolin-2-one
CID 142059903
6-methyl-2-[5-(2-piperidin-1-ylethoxy)-2-pyridinyl]-1H-benzimidazole
CID 158164125
4-[2-[[2-[3-(5-pyridazin-3-yl-2H-pyrimidin-1-yl)phenyl]-3H-benzimidazol-5-yl]oxy]ethyl]morpholine
CID 174175068
1-[4-(2-morpholin-4-ylethoxy)phenyl]butan-1-one
CID 66821978
2-methyl-5-(2-morpholin-4-ylethoxy)benzoic acid
CID 82165954

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?
The IUPAC name of N,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide (CID 135750802) is N,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide.
What is the SMILES notation for N,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?
The canonical SMILES for N,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide is CCN(CC)C(=O)N1CCc2[nH]nc(-c3nc4ccc(OCCN5CCOCC5)cc4[nH]3)c2C1.
What is the InChIKey of N,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?
The InChIKey is APYYIQSMKFHADA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H33N7O3/c1-3-30(4-2)24(32)31-8-7-19-18(16-31)22(28-27-19)23-25-20-6-5-17(15-21(20)26-23)34-14-11-29-9-12-33-13-10-29/h5-6,15H,3-4,7-14,16H2,1-2H3,(H,25,26)(H,27,28).
What are the key properties of N,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide?
N,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide has a molecular weight of 467.57 g/mol, XLogP of 2.48, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-[6-(2-morpholin-4-ylethoxy)-1H-benzimidazol-2-yl]-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine-5-carboxamide is sourced from PubChem (CID 135750802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).