1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide

C19H25N5O — CID 118450464

IUPAC1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide
SMILESCN(C)C(=O)C1CCN(c2cnccc2-n2cc(C3CC3)cn2)CC1
InChIInChI=1S/C19H25N5O/c1-22(2)19(25)15-6-9-23(10-7-15)18-12-20-8-5-17(18)24-13-16(11-21-24)14-3-4-14/h5,8,11-15H,3-4,6-7,9-10H2,1-2H3
InChIKeyKJDOXDIMWMEMOH-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.45
Rot. Bonds4

About 1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide

1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide (PubChem CID 118450464) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is 1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide
PubChem CID118450464
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC Name1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide
SMILESCN(C)C(=O)C1CCN(c2cnccc2-n2cc(C3CC3)cn2)CC1
InChIInChI=1S/C19H25N5O/c1-22(2)19(25)15-6-9-23(10-7-15)18-12-20-8-5-17(18)24-13-16(11-21-24)14-3-4-14/h5,8,11-15H,3-4,6-7,9-10H2,1-2H3
InChIKeyKJDOXDIMWMEMOH-UHFFFAOYSA-N
XLogP2.45
TPSA54.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide?
The IUPAC name of 1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide (CID 118450464) is 1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide?
The canonical SMILES for 1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide is CN(C)C(=O)C1CCN(c2cnccc2-n2cc(C3CC3)cn2)CC1.
What is the InChIKey of 1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide?
The InChIKey is KJDOXDIMWMEMOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O/c1-22(2)19(25)15-6-9-23(10-7-15)18-12-20-8-5-17(18)24-13-16(11-21-24)14-3-4-14/h5,8,11-15H,3-4,6-7,9-10H2,1-2H3.
What are the key properties of 1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide?
1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 2.45, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-cyclopropylpyrazol-1-yl)-3-pyridinyl]-N,N-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 118450464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).