N-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide

C20H29N3O2 — CID 67464734

IUPACN-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide
SMILESO=C(c1cccc(N2CCCCC2)n1)N(C1CCC(O)CC1)C1CC1
InChIInChI=1S/C20H29N3O2/c24-17-11-9-16(10-12-17)23(15-7-8-15)20(25)18-5-4-6-19(21-18)22-13-2-1-3-14-22/h4-6,15-17,24H,1-3,7-14H2
InChIKeyJLYIRQFUBJUIOQ-UHFFFAOYSA-N
MW343.47 g/mol
LogP2.98
Rot. Bonds4

About N-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide

N-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide (PubChem CID 67464734) has the molecular formula C20H29N3O2 and a molecular weight of 343.47 g/mol. Its IUPAC name is N-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide
PubChem CID67464734
Molecular FormulaC20H29N3O2
Molecular Weight343.47 g/mol
Exact Mass343.23
IUPAC NameN-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide
SMILESO=C(c1cccc(N2CCCCC2)n1)N(C1CCC(O)CC1)C1CC1
InChIInChI=1S/C20H29N3O2/c24-17-11-9-16(10-12-17)23(15-7-8-15)20(25)18-5-4-6-19(21-18)22-13-2-1-3-14-22/h4-6,15-17,24H,1-3,7-14H2
InChIKeyJLYIRQFUBJUIOQ-UHFFFAOYSA-N
XLogP2.98
TPSA56.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.47
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide?
The IUPAC name of N-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide (CID 67464734) is N-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide is O=C(c1cccc(N2CCCCC2)n1)N(C1CCC(O)CC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide?
The InChIKey is JLYIRQFUBJUIOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N3O2/c24-17-11-9-16(10-12-17)23(15-7-8-15)20(25)18-5-4-6-19(21-18)22-13-2-1-3-14-22/h4-6,15-17,24H,1-3,7-14H2.
What are the key properties of N-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide?
N-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide has a molecular weight of 343.47 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(4-hydroxycyclohexyl)-6-piperidin-1-ylpyridine-2-carboxamide is sourced from PubChem (CID 67464734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).