2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide

C20H29N3O3 — CID 126935618

IUPAC2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide
SMILESO=C(CC1CCCO1)NC1CCC(n2nc3c(cc2=O)CCCC3)CC1
InChIInChI=1S/C20H29N3O3/c24-19(13-17-5-3-11-26-17)21-15-7-9-16(10-8-15)23-20(25)12-14-4-1-2-6-18(14)22-23/h12,15-17H,1-11,13H2,(H,21,24)
InChIKeyDZFWSMDPZDWCQP-UHFFFAOYSA-N
MW359.47 g/mol
LogP2.29
Rot. Bonds4

About 2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide

2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide (PubChem CID 126935618) has the molecular formula C20H29N3O3 and a molecular weight of 359.47 g/mol. Its IUPAC name is 2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide.

Molecular Properties

Compound Name2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide
PubChem CID126935618
Molecular FormulaC20H29N3O3
Molecular Weight359.47 g/mol
Exact Mass359.22
IUPAC Name2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide
SMILESO=C(CC1CCCO1)NC1CCC(n2nc3c(cc2=O)CCCC3)CC1
InChIInChI=1S/C20H29N3O3/c24-19(13-17-5-3-11-26-17)21-15-7-9-16(10-8-15)23-20(25)12-14-4-1-2-6-18(14)22-23/h12,15-17H,1-11,13H2,(H,21,24)
InChIKeyDZFWSMDPZDWCQP-UHFFFAOYSA-N
XLogP2.29
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide 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

1-(oxan-4-yl)-3-[4-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)cyclohexyl]urea
CID 126935296
N-cyclopropyl-2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)acetamide
CID 75465729
N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]oxolane-3-carboxamide
CID 126935615
N-[4-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)cyclohexyl]cyclopent-3-ene-1-carboxamide
CID 126935332
1-(4-fluorophenyl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]cyclopropane-1-carboxamide
CID 126935616
2-[4-(cyclopropylmethylamino)cyclohexyl]-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-one
CID 126935392
2-[4-(pyrimidin-2-ylamino)cyclohexyl]-5,6,7,8-tetrahydrocinnolin-3-one
CID 126935702
5,7-dimethyl-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 126935642
2-[4-(thian-4-ylamino)cyclohexyl]-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-one
CID 126935544
2-[[1-(oxolan-2-ylmethyl)azetidin-3-yl]methyl]-5,6,7,8-tetrahydrocinnolin-3-one
CID 126928830
1-methyl-2-oxo-N-[4-(3-oxo-6,7-dihydro-5H-cyclopenta[c]pyridazin-2-yl)cyclohexyl]pyridine-3-carboxamide
CID 126935258
N-[(2R)-1-(3-oxo-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridazin-2-yl)propan-2-yl]oxolane-2-carboxamide
CID 110211154

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide?
The IUPAC name of 2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide (CID 126935618) is 2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide.
What is the SMILES notation for 2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide?
The canonical SMILES for 2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide is O=C(CC1CCCO1)NC1CCC(n2nc3c(cc2=O)CCCC3)CC1.
What is the InChIKey of 2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide?
The InChIKey is DZFWSMDPZDWCQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O3/c24-19(13-17-5-3-11-26-17)21-15-7-9-16(10-8-15)23-20(25)12-14-4-1-2-6-18(14)22-23/h12,15-17H,1-11,13H2,(H,21,24).
What are the key properties of 2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide?
2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide has a molecular weight of 359.47 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-yl)-N-[4-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)cyclohexyl]acetamide is sourced from PubChem (CID 126935618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).