(2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide

C23H30N2O2 — CID 155563178

IUPAC(2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide
SMILESCCCOc1cc(C)c2c(c1C)C[C@H]([C@@H](C)C(=O)Nc1ccccn1)CC2
InChIInChI=1S/C23H30N2O2/c1-5-12-27-21-13-15(2)19-10-9-18(14-20(19)17(21)4)16(3)23(26)25-22-8-6-7-11-24-22/h6-8,11,13,16,18H,5,9-10,12,14H2,1-4H3,(H,24,25,26)/t16-,18-/m1/s1
InChIKeyWWQBRKMNPXXKQJ-SJLPKXTDSA-N
MW366.51 g/mol
LogP4.87
Rot. Bonds6

About (2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide

(2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide (PubChem CID 155563178) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is (2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide.

Molecular Properties

Compound Name(2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide
PubChem CID155563178
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC Name(2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide
SMILESCCCOc1cc(C)c2c(c1C)C[C@H]([C@@H](C)C(=O)Nc1ccccn1)CC2
InChIInChI=1S/C23H30N2O2/c1-5-12-27-21-13-15(2)19-10-9-18(14-20(19)17(21)4)16(3)23(26)25-22-8-6-7-11-24-22/h6-8,11,13,16,18H,5,9-10,12,14H2,1-4H3,(H,24,25,26)/t16-,18-/m1/s1
InChIKeyWWQBRKMNPXXKQJ-SJLPKXTDSA-N
XLogP4.87
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide?
The IUPAC name of (2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide (CID 155563178) is (2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide.
What is the SMILES notation for (2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide?
The canonical SMILES for (2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide is CCCOc1cc(C)c2c(c1C)C[C@H]([C@@H](C)C(=O)Nc1ccccn1)CC2.
What is the InChIKey of (2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide?
The InChIKey is WWQBRKMNPXXKQJ-SJLPKXTDSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-5-12-27-21-13-15(2)19-10-9-18(14-20(19)17(21)4)16(3)23(26)25-22-8-6-7-11-24-22/h6-8,11,13,16,18H,5,9-10,12,14H2,1-4H3,(H,24,25,26)/t16-,18-/m1/s1.
What are the key properties of (2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide?
(2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide has a molecular weight of 366.51 g/mol, XLogP of 4.87, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2R)-5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphthalen-2-yl]-N-pyridin-2-ylpropanamide is sourced from PubChem (CID 155563178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).