N-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide

C21H24N4O3 — CID 167927281

IUPACN-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide
SMILESCOc1ccc2ccccc2c1NC(=O)c1cnn(CCN2CCOCC2)c1
InChIInChI=1S/C21H24N4O3/c1-27-19-7-6-16-4-2-3-5-18(16)20(19)23-21(26)17-14-22-25(15-17)9-8-24-10-12-28-13-11-24/h2-7,14-15H,8-13H2,1H3,(H,23,26)
InChIKeyNVLUCOPKAVQFOV-UHFFFAOYSA-N
MW380.45 g/mol
LogP2.63
Rot. Bonds6

About N-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide

N-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide (PubChem CID 167927281) has the molecular formula C21H24N4O3 and a molecular weight of 380.45 g/mol. Its IUPAC name is N-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide
PubChem CID167927281
Molecular FormulaC21H24N4O3
Molecular Weight380.45 g/mol
Exact Mass380.18
IUPAC NameN-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide
SMILESCOc1ccc2ccccc2c1NC(=O)c1cnn(CCN2CCOCC2)c1
InChIInChI=1S/C21H24N4O3/c1-27-19-7-6-16-4-2-3-5-18(16)20(19)23-21(26)17-14-22-25(15-17)9-8-24-10-12-28-13-11-24/h2-7,14-15H,8-13H2,1H3,(H,23,26)
InChIKeyNVLUCOPKAVQFOV-UHFFFAOYSA-N
XLogP2.63
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.45
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-methyl-N-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]benzamide
CID 121419957
N-(2-methoxyphenyl)-1-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide
CID 53040738
N-[(2-methoxynaphthalen-1-yl)methyl]-3-morpholin-4-ylpropan-1-amine chloride
CID 53350960
1-[2-(2-methoxyphenyl)ethyl]-3-(2-morpholin-4-ylethyl)urea
CID 110408119
4-(carbamoylamino)-N-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]benzamide
CID 136523469
3-methoxy-N-(3-morpholin-4-ylpropyl)naphthalene-2-carboxamide
CID 17462757
1-benzyl-N-[2-(morpholin-4-ylmethyl)phenyl]pyrazole-4-carboxamide
CID 131931531
N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]-2-morpholin-4-ylacetamide
CID 75124053
4-[(dimethylamino)methyl]-N-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]benzamide
CID 136523458
5-[2-(2-methoxyphenyl)ethylamino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 109229476
2-(2-methoxyphenyl)-N-(3-morpholin-4-ylpropyl)quinoline-4-carboxamide
CID 2965752
6-chloro-N-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]pyridine-3-carboxamide
CID 136523476

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide?
The IUPAC name of N-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide (CID 167927281) is N-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide.
What is the SMILES notation for N-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide?
The canonical SMILES for N-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide is COc1ccc2ccccc2c1NC(=O)c1cnn(CCN2CCOCC2)c1.
What is the InChIKey of N-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide?
The InChIKey is NVLUCOPKAVQFOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N4O3/c1-27-19-7-6-16-4-2-3-5-18(16)20(19)23-21(26)17-14-22-25(15-17)9-8-24-10-12-28-13-11-24/h2-7,14-15H,8-13H2,1H3,(H,23,26).
What are the key properties of N-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide?
N-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide has a molecular weight of 380.45 g/mol, XLogP of 2.63, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxynaphthalen-1-yl)-1-(2-morpholin-4-ylethyl)pyrazole-4-carboxamide is sourced from PubChem (CID 167927281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).