N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide

C18H27N3O2 — CID 97023794

IUPACN-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCC1CCN(c2ccc(C(=O)N[C@@](C)(CO)C3CC3)cn2)CC1
InChIInChI=1S/C18H27N3O2/c1-13-7-9-21(10-8-13)16-6-3-14(11-19-16)17(23)20-18(2,12-22)15-4-5-15/h3,6,11,13,15,22H,4-5,7-10,12H2,1-2H3,(H,20,23)/t18-/m0/s1
InChIKeyUFQKEKWSENRQLY-SFHVURJKSA-N
MW317.43 g/mol
LogP2.21
Rot. Bonds5

About N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide

N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (PubChem CID 97023794) has the molecular formula C18H27N3O2 and a molecular weight of 317.43 g/mol. Its IUPAC name is N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
PubChem CID97023794
Molecular FormulaC18H27N3O2
Molecular Weight317.43 g/mol
Exact Mass317.21
IUPAC NameN-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
SMILESCC1CCN(c2ccc(C(=O)N[C@@](C)(CO)C3CC3)cn2)CC1
InChIInChI=1S/C18H27N3O2/c1-13-7-9-21(10-8-13)16-6-3-14(11-19-16)17(23)20-18(2,12-22)15-4-5-15/h3,6,11,13,15,22H,4-5,7-10,12H2,1-2H3,(H,20,23)/t18-/m0/s1
InChIKeyUFQKEKWSENRQLY-SFHVURJKSA-N
XLogP2.21
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide (CID 97023794) is N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is CC1CCN(c2ccc(C(=O)N[C@@](C)(CO)C3CC3)cn2)CC1.
What is the InChIKey of N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
The InChIKey is UFQKEKWSENRQLY-SFHVURJKSA-N. The full InChI is InChI=1S/C18H27N3O2/c1-13-7-9-21(10-8-13)16-6-3-14(11-19-16)17(23)20-18(2,12-22)15-4-5-15/h3,6,11,13,15,22H,4-5,7-10,12H2,1-2H3,(H,20,23)/t18-/m0/s1.
What are the key properties of N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide?
N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide has a molecular weight of 317.43 g/mol, XLogP of 2.21, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-cyclopropyl-1-hydroxypropan-2-yl]-6-(4-methylpiperidin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 97023794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).