N-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide

C18H21N5O2 — CID 172903018

IUPACN-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide
SMILESCN(C(=O)c1cnn(C)c1)C1CCN(c2nccc3occc23)CC1
InChIInChI=1S/C18H21N5O2/c1-21-12-13(11-20-21)18(24)22(2)14-4-8-23(9-5-14)17-15-6-10-25-16(15)3-7-19-17/h3,6-7,10-12,14H,4-5,8-9H2,1-2H3
InChIKeyHQKPLZLMWGFBFU-UHFFFAOYSA-N
MW339.40 g/mol
LogP2.30
Rot. Bonds3

About N-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide

N-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide (PubChem CID 172903018) has the molecular formula C18H21N5O2 and a molecular weight of 339.40 g/mol. Its IUPAC name is N-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide
PubChem CID172903018
Molecular FormulaC18H21N5O2
Molecular Weight339.40 g/mol
Exact Mass339.17
IUPAC NameN-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide
SMILESCN(C(=O)c1cnn(C)c1)C1CCN(c2nccc3occc23)CC1
InChIInChI=1S/C18H21N5O2/c1-21-12-13(11-20-21)18(24)22(2)14-4-8-23(9-5-14)17-15-6-10-25-16(15)3-7-19-17/h3,6-7,10-12,14H,4-5,8-9H2,1-2H3
InChIKeyHQKPLZLMWGFBFU-UHFFFAOYSA-N
XLogP2.30
TPSA67.40 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide?
The IUPAC name of N-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide (CID 172903018) is N-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide.
What is the SMILES notation for N-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide?
The canonical SMILES for N-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide is CN(C(=O)c1cnn(C)c1)C1CCN(c2nccc3occc23)CC1.
What is the InChIKey of N-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide?
The InChIKey is HQKPLZLMWGFBFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O2/c1-21-12-13(11-20-21)18(24)22(2)14-4-8-23(9-5-14)17-15-6-10-25-16(15)3-7-19-17/h3,6-7,10-12,14H,4-5,8-9H2,1-2H3.
What are the key properties of N-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide?
N-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide has a molecular weight of 339.40 g/mol, XLogP of 2.30, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-furo[3,2-c]pyridin-4-ylpiperidin-4-yl)-N,1-dimethylpyrazole-4-carboxamide is sourced from PubChem (CID 172903018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).