5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide

C19H28N2O3 — CID 71105647

IUPAC5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide
SMILESCC(C)[C@](C)(CO)NC(=O)c1ccc(C2CC2)c(OCC2CC2)n1
InChIInChI=1S/C19H28N2O3/c1-12(2)19(3,11-22)21-17(23)16-9-8-15(14-6-7-14)18(20-16)24-10-13-4-5-13/h8-9,12-14,22H,4-7,10-11H2,1-3H3,(H,21,23)/t19-/m0/s1
InChIKeyUQBZMSMREMTJPR-IBGZPJMESA-N
MW332.44 g/mol
LogP2.88
Rot. Bonds8

About 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide

5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide (PubChem CID 71105647) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide
PubChem CID71105647
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC Name5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide
SMILESCC(C)[C@](C)(CO)NC(=O)c1ccc(C2CC2)c(OCC2CC2)n1
InChIInChI=1S/C19H28N2O3/c1-12(2)19(3,11-22)21-17(23)16-9-8-15(14-6-7-14)18(20-16)24-10-13-4-5-13/h8-9,12-14,22H,4-7,10-11H2,1-3H3,(H,21,23)/t19-/m0/s1
InChIKeyUQBZMSMREMTJPR-IBGZPJMESA-N
XLogP2.88
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide?
The IUPAC name of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide (CID 71105647) is 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide.
What is the SMILES notation for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide?
The canonical SMILES for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide is CC(C)[C@](C)(CO)NC(=O)c1ccc(C2CC2)c(OCC2CC2)n1.
What is the InChIKey of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide?
The InChIKey is UQBZMSMREMTJPR-IBGZPJMESA-N. The full InChI is InChI=1S/C19H28N2O3/c1-12(2)19(3,11-22)21-17(23)16-9-8-15(14-6-7-14)18(20-16)24-10-13-4-5-13/h8-9,12-14,22H,4-7,10-11H2,1-3H3,(H,21,23)/t19-/m0/s1.
What are the key properties of 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide?
5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide has a molecular weight of 332.44 g/mol, XLogP of 2.88, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-6-(cyclopropylmethoxy)-N-[(2R)-1-hydroxy-2,3-dimethylbutan-2-yl]pyridine-2-carboxamide is sourced from PubChem (CID 71105647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).