N-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride

C16H29Cl2N5O — CID 167923252

IUPACN-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride
SMILESCCCN1CCC(N(C)C(=O)c2n[nH]c3c2CNCC3)CC1.Cl.Cl
InChIInChI=1S/C16H27N5O.2ClH/c1-3-8-21-9-5-12(6-10-21)20(2)16(22)15-13-11-17-7-4-14(13)18-19-15;;/h12,17H,3-11H2,1-2H3,(H,18,19);2*1H
InChIKeyBULGYLNCPLKNRP-UHFFFAOYSA-N
MW378.35 g/mol
LogP1.85
Rot. Bonds4

About N-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride

N-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride (PubChem CID 167923252) has the molecular formula C16H29Cl2N5O and a molecular weight of 378.35 g/mol. Its IUPAC name is N-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride
PubChem CID167923252
Molecular FormulaC16H29Cl2N5O
Molecular Weight378.35 g/mol
Exact Mass377.17
IUPAC NameN-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride
SMILESCCCN1CCC(N(C)C(=O)c2n[nH]c3c2CNCC3)CC1.Cl.Cl
InChIInChI=1S/C16H27N5O.2ClH/c1-3-8-21-9-5-12(6-10-21)20(2)16(22)15-13-11-17-7-4-14(13)18-19-15;;/h12,17H,3-11H2,1-2H3,(H,18,19);2*1H
InChIKeyBULGYLNCPLKNRP-UHFFFAOYSA-N
XLogP1.85
TPSA64.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.35
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride
CID 56832000
N-cyclohexyl-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 56832001
N-[1-(methoxymethyl)cyclopropyl]-N-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride
CID 154697746
2,6-dichloro-N-methyl-N-(1-propylpiperidin-4-yl)pyridine-4-carboxamide
CID 61044792
4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride
CID 56832020
4-bromo-N-methyl-N-(1-propylpiperidin-4-yl)benzamide
CID 61041639
N-[3-(dimethylamino)propyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 56832173
N-[[4-(dimethylcarbamoyl)phenyl]methyl]-N-ethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 126766167
N-methyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride
CID 50944244
6-fluoro-N-methyl-N-(1-propylpiperidin-4-yl)pyridine-3-carboxamide
CID 63978585
5,6-dichloro-N-methyl-N-(1-propylpiperidin-4-yl)pyridine-3-carboxamide
CID 61051847
(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)methanone;hydrochloride
CID 154753957

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride?
The IUPAC name of N-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride (CID 167923252) is N-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride.
What is the SMILES notation for N-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride?
The canonical SMILES for N-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride is CCCN1CCC(N(C)C(=O)c2n[nH]c3c2CNCC3)CC1.Cl.Cl.
What is the InChIKey of N-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride?
The InChIKey is BULGYLNCPLKNRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N5O.2ClH/c1-3-8-21-9-5-12(6-10-21)20(2)16(22)15-13-11-17-7-4-14(13)18-19-15;;/h12,17H,3-11H2,1-2H3,(H,18,19);2*1H.
What are the key properties of N-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride?
N-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride has a molecular weight of 378.35 g/mol, XLogP of 1.85, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-propylpiperidin-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;dihydrochloride is sourced from PubChem (CID 167923252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).