N-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide

C22H28N2O2 — CID 42796822

IUPACN-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide
SMILESO=C(C1CCCO1)N(Cc1ccc2ccccc2n1)CC1CCCCC1
InChIInChI=1S/C22H28N2O2/c25-22(21-11-6-14-26-21)24(15-17-7-2-1-3-8-17)16-19-13-12-18-9-4-5-10-20(18)23-19/h4-5,9-10,12-13,17,21H,1-3,6-8,11,14-16H2
InChIKeyBIUIDUZODOJHEU-UHFFFAOYSA-N
MW352.48 g/mol
LogP4.32
Rot. Bonds5

About N-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide

N-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide (PubChem CID 42796822) has the molecular formula C22H28N2O2 and a molecular weight of 352.48 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide
PubChem CID42796822
Molecular FormulaC22H28N2O2
Molecular Weight352.48 g/mol
Exact Mass352.22
IUPAC NameN-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide
SMILESO=C(C1CCCO1)N(Cc1ccc2ccccc2n1)CC1CCCCC1
InChIInChI=1S/C22H28N2O2/c25-22(21-11-6-14-26-21)24(15-17-7-2-1-3-8-17)16-19-13-12-18-9-4-5-10-20(18)23-19/h4-5,9-10,12-13,17,21H,1-3,6-8,11,14-16H2
InChIKeyBIUIDUZODOJHEU-UHFFFAOYSA-N
XLogP4.32
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-phenylethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide
CID 42789365
1-cyclohexyl-N-(quinolin-2-ylmethyl)methanamine
CID 43216158
oxolan-2-yl-(4-quinolin-2-ylpiperazin-1-yl)methanone
CID 108741501
2-(2-chloro-3-cycloheptylpropyl)quinoline
CID 114459396
N-cyclohexyl-2-quinolin-2-ylacetamide
CID 110464171
(2R)-N-benzyl-N-(3,3,3-trifluoropropyl)oxolane-2-carboxamide
CID 99834856
2-bromo-N-methyl-N-(quinolin-2-ylmethyl)cyclohexan-1-amine
CID 102637233
(2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide
CID 2036915
benzyl(cyclohexylmethyl)carbamic acid
CID 57063774
4-N-methyl-4-N-(quinolin-2-ylmethyl)cyclohexane-1,4-diamine
CID 79112911
trans-(1R,2R)-1-N,2-N-dibenzyl-1-N,2-N-bis(quinolin-2-ylmethyl)cyclohexane-1,2-diamine
CID 102375757
[1-(oxolan-2-yl)-2-quinolin-2-ylethyl]hydrazine
CID 105228979

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide?
The IUPAC name of N-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide (CID 42796822) is N-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide?
The canonical SMILES for N-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide is O=C(C1CCCO1)N(Cc1ccc2ccccc2n1)CC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide?
The InChIKey is BIUIDUZODOJHEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O2/c25-22(21-11-6-14-26-21)24(15-17-7-2-1-3-8-17)16-19-13-12-18-9-4-5-10-20(18)23-19/h4-5,9-10,12-13,17,21H,1-3,6-8,11,14-16H2.
What are the key properties of N-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide?
N-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide has a molecular weight of 352.48 g/mol, XLogP of 4.32, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-N-(quinolin-2-ylmethyl)oxolane-2-carboxamide is sourced from PubChem (CID 42796822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).