N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide

C21H25N5O — CID 3866532

IUPACN-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide
SMILESCc1ccc2cc(CN(C(=O)C3CC3)C3CCCCC3)c3nnnn3c2c1
InChIInChI=1S/C21H25N5O/c1-14-7-8-16-12-17(20-22-23-24-26(20)19(16)11-14)13-25(21(27)15-9-10-15)18-5-3-2-4-6-18/h7-8,11-12,15,18H,2-6,9-10,13H2,1H3
InChIKeyGMOJWLYPCZXWNJ-UHFFFAOYSA-N
MW363.47 g/mol
LogP3.66
Rot. Bonds4

About N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide

N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide (PubChem CID 3866532) has the molecular formula C21H25N5O and a molecular weight of 363.47 g/mol. Its IUPAC name is N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide
PubChem CID3866532
Molecular FormulaC21H25N5O
Molecular Weight363.47 g/mol
Exact Mass363.21
IUPAC NameN-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide
SMILESCc1ccc2cc(CN(C(=O)C3CC3)C3CCCCC3)c3nnnn3c2c1
InChIInChI=1S/C21H25N5O/c1-14-7-8-16-12-17(20-22-23-24-26(20)19(16)11-14)13-25(21(27)15-9-10-15)18-5-3-2-4-6-18/h7-8,11-12,15,18H,2-6,9-10,13H2,1H3
InChIKeyGMOJWLYPCZXWNJ-UHFFFAOYSA-N
XLogP3.66
TPSA63.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.47
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopentyl-N-[(7,8-dimethyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclobutanecarboxamide
CID 1459619
N-cyclopentyl-3,5-dimethoxy-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]benzamide
CID 3216791
N-cyclopentyl-N-[(8,9-dimethyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclobutanecarboxamide
CID 1459577
N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]-N-(oxolan-2-ylmethyl)cyclobutanecarboxamide
CID 3216808
3-(2-chlorophenyl)-1-cyclohexyl-1-[(7-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]urea
CID 6498545
1-cyclopentyl-3-(2-methylphenyl)-1-[(7-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]urea
CID 1466341
N-cyclohexyl-N-[(7,8-dimethyltetrazolo[1,5-a]quinolin-4-yl)methyl]-2-methoxyacetamide
CID 1459626
3-butyl-1-cyclopentyl-1-[(7-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]thiourea
CID 3221115
N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]acetamide
CID 1432131
1-cyclopentyl-3-(3-methylphenyl)-1-[(7-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]thiourea
CID 1445458
1-cyclopentyl-3-(4-fluorophenyl)-1-[(7-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]thiourea
CID 6498524
N-[(2-chloro-6-methylquinolin-3-yl)methyl]-N-cyclopentylcyclopropanecarboxamide
CID 856830

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide?
The IUPAC name of N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide (CID 3866532) is N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide?
The canonical SMILES for N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide is Cc1ccc2cc(CN(C(=O)C3CC3)C3CCCCC3)c3nnnn3c2c1.
What is the InChIKey of N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide?
The InChIKey is GMOJWLYPCZXWNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O/c1-14-7-8-16-12-17(20-22-23-24-26(20)19(16)11-14)13-25(21(27)15-9-10-15)18-5-3-2-4-6-18/h7-8,11-12,15,18H,2-6,9-10,13H2,1H3.
What are the key properties of N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide?
N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide has a molecular weight of 363.47 g/mol, XLogP of 3.66, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-[(8-methyltetrazolo[1,5-a]quinolin-4-yl)methyl]cyclopropanecarboxamide is sourced from PubChem (CID 3866532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).