[1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol

C13H19N5O — CID 131695725

IUPAC[1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol
SMILESCn1cc(CN2Cc3ncn(C)c3CC2CO)cn1
InChIInChI=1S/C13H19N5O/c1-16-9-14-12-7-18(11(8-19)3-13(12)16)6-10-4-15-17(2)5-10/h4-5,9,11,19H,3,6-8H2,1-2H3
InChIKeyKHLDUXYSEFMETD-UHFFFAOYSA-N
MW261.33 g/mol
LogP0.07
Rot. Bonds3

About [1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol

[1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol (PubChem CID 131695725) has the molecular formula C13H19N5O and a molecular weight of 261.33 g/mol. Its IUPAC name is [1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol.

Molecular Properties

Compound Name[1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol
PubChem CID131695725
Molecular FormulaC13H19N5O
Molecular Weight261.33 g/mol
Exact Mass261.16
IUPAC Name[1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol
SMILESCn1cc(CN2Cc3ncn(C)c3CC2CO)cn1
InChIInChI=1S/C13H19N5O/c1-16-9-14-12-7-18(11(8-19)3-13(12)16)6-10-4-15-17(2)5-10/h4-5,9,11,19H,3,6-8H2,1-2H3
InChIKeyKHLDUXYSEFMETD-UHFFFAOYSA-N
XLogP0.07
TPSA59.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol?
The IUPAC name of [1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol (CID 131695725) is [1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol.
What is the SMILES notation for [1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol?
The canonical SMILES for [1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol is Cn1cc(CN2Cc3ncn(C)c3CC2CO)cn1.
What is the InChIKey of [1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol?
The InChIKey is KHLDUXYSEFMETD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O/c1-16-9-14-12-7-18(11(8-19)3-13(12)16)6-10-4-15-17(2)5-10/h4-5,9,11,19H,3,6-8H2,1-2H3.
What are the key properties of [1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol?
[1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol has a molecular weight of 261.33 g/mol, XLogP of 0.07, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-methyl-5-[(1-methylpyrazol-4-yl)methyl]-6,7-dihydro-4H-imidazo[4,5-c]pyridin-6-yl]methanol is sourced from PubChem (CID 131695725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).