N,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide

C18H30N4O3 — CID 118739393

IUPACN,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide
SMILESCN(C)C(=O)COCC1CN(CC2CCOCC2)Cc2ncn(C)c21
InChIInChI=1S/C18H30N4O3/c1-20(2)17(23)12-25-11-15-9-22(8-14-4-6-24-7-5-14)10-16-18(15)21(3)13-19-16/h13-15H,4-12H2,1-3H3
InChIKeyUZHXFXBEYACRRR-UHFFFAOYSA-N
MW350.46 g/mol
LogP0.85
Rot. Bonds6

About N,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide

N,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide (PubChem CID 118739393) has the molecular formula C18H30N4O3 and a molecular weight of 350.46 g/mol. Its IUPAC name is N,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide
PubChem CID118739393
Molecular FormulaC18H30N4O3
Molecular Weight350.46 g/mol
Exact Mass350.23
IUPAC NameN,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide
SMILESCN(C)C(=O)COCC1CN(CC2CCOCC2)Cc2ncn(C)c21
InChIInChI=1S/C18H30N4O3/c1-20(2)17(23)12-25-11-15-9-22(8-14-4-6-24-7-5-14)10-16-18(15)21(3)13-19-16/h13-15H,4-12H2,1-3H3
InChIKeyUZHXFXBEYACRRR-UHFFFAOYSA-N
XLogP0.85
TPSA59.83 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 50.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide?
The IUPAC name of N,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide (CID 118739393) is N,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide?
The canonical SMILES for N,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide is CN(C)C(=O)COCC1CN(CC2CCOCC2)Cc2ncn(C)c21.
What is the InChIKey of N,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide?
The InChIKey is UZHXFXBEYACRRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N4O3/c1-20(2)17(23)12-25-11-15-9-22(8-14-4-6-24-7-5-14)10-16-18(15)21(3)13-19-16/h13-15H,4-12H2,1-3H3.
What are the key properties of N,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide?
N,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide has a molecular weight of 350.46 g/mol, XLogP of 0.85, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[[1-methyl-5-(oxan-4-ylmethyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-7-yl]methoxy]acetamide is sourced from PubChem (CID 118739393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).