N,N-dimethyl-2-[[1-methyl-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide

C19H27N5O2 — CID 97405822

IUPACN,N-dimethyl-2-[[1-methyl-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide
SMILESCc1cccc(CN2CCc3c(COCC(=O)N(C)C)nn(C)c3C2)n1
InChIInChI=1S/C19H27N5O2/c1-14-6-5-7-15(20-14)10-24-9-8-16-17(21-23(4)18(16)11-24)12-26-13-19(25)22(2)3/h5-7H,8-13H2,1-4H3
InChIKeySXKFYACMLZIDPQ-UHFFFAOYSA-N
MW357.46 g/mol
LogP1.29
Rot. Bonds6

About N,N-dimethyl-2-[[1-methyl-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide

N,N-dimethyl-2-[[1-methyl-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide (PubChem CID 97405822) has the molecular formula C19H27N5O2 and a molecular weight of 357.46 g/mol. Its IUPAC name is N,N-dimethyl-2-[[1-methyl-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[[1-methyl-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide
PubChem CID97405822
Molecular FormulaC19H27N5O2
Molecular Weight357.46 g/mol
Exact Mass357.22
IUPAC NameN,N-dimethyl-2-[[1-methyl-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide
SMILESCc1cccc(CN2CCc3c(COCC(=O)N(C)C)nn(C)c3C2)n1
InChIInChI=1S/C19H27N5O2/c1-14-6-5-7-15(20-14)10-24-9-8-16-17(21-23(4)18(16)11-24)12-26-13-19(25)22(2)3/h5-7H,8-13H2,1-4H3
InChIKeySXKFYACMLZIDPQ-UHFFFAOYSA-N
XLogP1.29
TPSA63.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 51.29
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-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide?
The IUPAC name of N,N-dimethyl-2-[[1-methyl-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide (CID 97405822) is N,N-dimethyl-2-[[1-methyl-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide.
What is the SMILES notation for N,N-dimethyl-2-[[1-methyl-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide?
The canonical SMILES for N,N-dimethyl-2-[[1-methyl-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide is Cc1cccc(CN2CCc3c(COCC(=O)N(C)C)nn(C)c3C2)n1.
What is the InChIKey of N,N-dimethyl-2-[[1-methyl-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide?
The InChIKey is SXKFYACMLZIDPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O2/c1-14-6-5-7-15(20-14)10-24-9-8-16-17(21-23(4)18(16)11-24)12-26-13-19(25)22(2)3/h5-7H,8-13H2,1-4H3.
What are the key properties of N,N-dimethyl-2-[[1-methyl-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide?
N,N-dimethyl-2-[[1-methyl-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide has a molecular weight of 357.46 g/mol, XLogP of 1.29, 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-6-[(6-methyl-2-pyridinyl)methyl]-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-3-yl]methoxy]acetamide is sourced from PubChem (CID 97405822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).