N-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide

C23H32N4O3 — CID 155874996

IUPACN-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide
SMILESCc1nc2ccccn2c1CN1CCOC2(COC(C(=O)NC3CCCCC3)C2)C1
InChIInChI=1S/C23H32N4O3/c1-17-19(27-10-6-5-9-21(27)24-17)14-26-11-12-30-23(15-26)13-20(29-16-23)22(28)25-18-7-3-2-4-8-18/h5-6,9-10,18,20H,2-4,7-8,11-16H2,1H3,(H,25,28)
InChIKeyABSIBCOCIPLNSU-UHFFFAOYSA-N
MW412.53 g/mol
LogP2.45
Rot. Bonds4

About N-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide

N-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide (PubChem CID 155874996) has the molecular formula C23H32N4O3 and a molecular weight of 412.53 g/mol. Its IUPAC name is N-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide
PubChem CID155874996
Molecular FormulaC23H32N4O3
Molecular Weight412.53 g/mol
Exact Mass412.25
IUPAC NameN-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide
SMILESCc1nc2ccccn2c1CN1CCOC2(COC(C(=O)NC3CCCCC3)C2)C1
InChIInChI=1S/C23H32N4O3/c1-17-19(27-10-6-5-9-21(27)24-17)14-26-11-12-30-23(15-26)13-20(29-16-23)22(28)25-18-7-3-2-4-8-18/h5-6,9-10,18,20H,2-4,7-8,11-16H2,1H3,(H,25,28)
InChIKeyABSIBCOCIPLNSU-UHFFFAOYSA-N
XLogP2.45
TPSA68.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.53
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide with MolForge

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Related Compounds

1-[9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carbonyl]piperidine-3-carboxamide
CID 155880283
N-(1,1-dioxothietan-3-yl)-9-(pyridin-4-ylmethyl)-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide
CID 131682731
methyl 2-[4-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]morpholin-2-yl]acetate
CID 84587348
N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]cyclohexanamine
CID 43755994
9-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-N-[(4-methylphenyl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide
CID 155880236
N-methyl-4-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]spiro[3,5-dihydro-1,4-benzoxazepine-2,4'-cyclohexane]-1'-amine
CID 92595801
1-[(6S,9R,10S)-9-(4-fluorophenyl)-10-propan-2-yl-1,8-dioxa-4-azaspiro[5.5]undecan-4-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone
CID 110154911
9-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-N-[(4-fluorophenyl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide
CID 155880232
1-[(5S,6S)-6-hydroxy-1-oxa-9-azaspiro[4.5]decan-9-yl]-2-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanone
CID 110156945
1-[9-[(6-methoxy-5-methyl-3-pyridinyl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carbonyl]piperidine-3-carboxamide
CID 155874993
2-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-[(2-methyloxolan-2-yl)methyl]acetamide
CID 110090746
(2R,3R)-N-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2-phenyloxolane-3-carboxamide
CID 136587872

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide?
The IUPAC name of N-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide (CID 155874996) is N-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide?
The canonical SMILES for N-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide is Cc1nc2ccccn2c1CN1CCOC2(COC(C(=O)NC3CCCCC3)C2)C1.
What is the InChIKey of N-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide?
The InChIKey is ABSIBCOCIPLNSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N4O3/c1-17-19(27-10-6-5-9-21(27)24-17)14-26-11-12-30-23(15-26)13-20(29-16-23)22(28)25-18-7-3-2-4-8-18/h5-6,9-10,18,20H,2-4,7-8,11-16H2,1H3,(H,25,28).
What are the key properties of N-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide?
N-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide has a molecular weight of 412.53 g/mol, XLogP of 2.45, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-9-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]-2,6-dioxa-9-azaspiro[4.5]decane-3-carboxamide is sourced from PubChem (CID 155874996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).