2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide

C21H25N5O2 — CID 160771814

IUPAC2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide
SMILESO=C(CC1CC1)Nc1cn[nH]c1C1=Nc2cc(CN3CCOCC3)ccc2C1
InChIInChI=1S/C21H25N5O2/c27-20(10-14-1-2-14)24-19-12-22-25-21(19)18-11-16-4-3-15(9-17(16)23-18)13-26-5-7-28-8-6-26/h3-4,9,12,14H,1-2,5-8,10-11,13H2,(H,22,25)(H,24,27)
InChIKeyRZKMKSLIMWOGJO-UHFFFAOYSA-N
MW379.46 g/mol
LogP2.66
Rot. Bonds6

About 2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide

2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide (PubChem CID 160771814) has the molecular formula C21H25N5O2 and a molecular weight of 379.46 g/mol. Its IUPAC name is 2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide.

Molecular Properties

Compound Name2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide
PubChem CID160771814
Molecular FormulaC21H25N5O2
Molecular Weight379.46 g/mol
Exact Mass379.20
IUPAC Name2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide
SMILESO=C(CC1CC1)Nc1cn[nH]c1C1=Nc2cc(CN3CCOCC3)ccc2C1
InChIInChI=1S/C21H25N5O2/c27-20(10-14-1-2-14)24-19-12-22-25-21(19)18-11-16-4-3-15(9-17(16)23-18)13-26-5-7-28-8-6-26/h3-4,9,12,14H,1-2,5-8,10-11,13H2,(H,22,25)(H,24,27)
InChIKeyRZKMKSLIMWOGJO-UHFFFAOYSA-N
XLogP2.66
TPSA82.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-methyl-5-(morpholin-4-ylmethyl)phenyl]-2-pyrrolidin-2-ylacetamide
CID 119890419
1-benzyl-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]piperidine-4-carboxamide
CID 136980396
butanoic acid;1-cyclopropyl-3-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]urea
CID 135869575
4,6-dimethyl-N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-2-oxo-3H-pyridine-3-carboxamide
CID 137043145
N-[2-amino-4-(morpholin-4-ylmethyl)phenyl]-4-(methylamino)-1H-pyrazole-5-carboxamide;N-[2-amino-5-(morpholin-4-ylmethyl)phenyl]-4-(methylamino)-1H-pyrazole-5-carboxamide;methane
CID 157400935
4-[2-amino-4-(morpholin-4-ylmethyl)anilino]-N-[2-amino-5-(morpholin-4-ylmethyl)phenyl]-1H-pyrazole-5-carboxamide
CID 25032506
4-amino-N-[2-methyl-5-(morpholin-4-ylmethyl)phenyl]butanamide;dihydrochloride
CID 119890424
2-cyclopentyl-N-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]acetamide
CID 60580220
2-(cyclopropylmethylamino)-N-[[3-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 119847373
2-(2-methoxyethylamino)-N-[2-methyl-5-(morpholin-4-ylmethyl)phenyl]acetamide;dihydrochloride
CID 119890420
7-amino-N-[2-methyl-5-(morpholin-4-ylmethyl)phenyl]heptanamide
CID 119890381
N-[5-[6-(morpholin-4-ylmethyl)-1H-benzimidazol-2-yl]-1H-pyrazol-4-yl]-1H-pyrrolo[1,2-a]imidazole-2-carboxamide
CID 136660705

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide?
The IUPAC name of 2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide (CID 160771814) is 2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide.
What is the SMILES notation for 2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide?
The canonical SMILES for 2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide is O=C(CC1CC1)Nc1cn[nH]c1C1=Nc2cc(CN3CCOCC3)ccc2C1.
What is the InChIKey of 2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide?
The InChIKey is RZKMKSLIMWOGJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O2/c27-20(10-14-1-2-14)24-19-12-22-25-21(19)18-11-16-4-3-15(9-17(16)23-18)13-26-5-7-28-8-6-26/h3-4,9,12,14H,1-2,5-8,10-11,13H2,(H,22,25)(H,24,27).
What are the key properties of 2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide?
2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide has a molecular weight of 379.46 g/mol, XLogP of 2.66, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-[5-[6-(morpholin-4-ylmethyl)-3H-indol-2-yl]-1H-pyrazol-4-yl]acetamide is sourced from PubChem (CID 160771814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).