(3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide

C15H28N2O3 — CID 124741783

IUPAC(3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide
SMILESCOC[C@@H]1CCCN(C(=O)N[C@@H]2CCCC[C@H]2OC)C1
InChIInChI=1S/C15H28N2O3/c1-19-11-12-6-5-9-17(10-12)15(18)16-13-7-3-4-8-14(13)20-2/h12-14H,3-11H2,1-2H3,(H,16,18)/t12-,13-,14-/m1/s1
InChIKeyWWWIGGQHKHMHRK-MGPQQGTHSA-N
MW284.40 g/mol
LogP2.01
Rot. Bonds4

About (3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide

(3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide (PubChem CID 124741783) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is (3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name(3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide
PubChem CID124741783
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Name(3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide
SMILESCOC[C@@H]1CCCN(C(=O)N[C@@H]2CCCC[C@H]2OC)C1
InChIInChI=1S/C15H28N2O3/c1-19-11-12-6-5-9-17(10-12)15(18)16-13-7-3-4-8-14(13)20-2/h12-14H,3-11H2,1-2H3,(H,16,18)/t12-,13-,14-/m1/s1
InChIKeyWWWIGGQHKHMHRK-MGPQQGTHSA-N
XLogP2.01
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide?
The IUPAC name of (3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide (CID 124741783) is (3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide.
What is the SMILES notation for (3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide?
The canonical SMILES for (3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide is COC[C@@H]1CCCN(C(=O)N[C@@H]2CCCC[C@H]2OC)C1.
What is the InChIKey of (3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide?
The InChIKey is WWWIGGQHKHMHRK-MGPQQGTHSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-19-11-12-6-5-9-17(10-12)15(18)16-13-7-3-4-8-14(13)20-2/h12-14H,3-11H2,1-2H3,(H,16,18)/t12-,13-,14-/m1/s1.
What are the key properties of (3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide?
(3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide has a molecular weight of 284.40 g/mol, XLogP of 2.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[(1R,2R)-2-methoxycyclohexyl]-3-(methoxymethyl)piperidine-1-carboxamide is sourced from PubChem (CID 124741783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).