4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine

C18H25N — CID 167678389

IUPAC4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine
SMILESCN1CC=C(c2ccc3c(c2)CC(C)(C)CC3)CC1
InChIInChI=1S/C18H25N/c1-18(2)9-6-14-4-5-16(12-17(14)13-18)15-7-10-19(3)11-8-15/h4-5,7,12H,6,8-11,13H2,1-3H3
InChIKeyCGRCNFIXJZLGCI-UHFFFAOYSA-N
MW255.40 g/mol
LogP3.92
Rot. Bonds1

About 4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine

4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine (PubChem CID 167678389) has the molecular formula C18H25N and a molecular weight of 255.40 g/mol. Its IUPAC name is 4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine
PubChem CID167678389
Molecular FormulaC18H25N
Molecular Weight255.40 g/mol
Exact Mass255.20
IUPAC Name4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine
SMILESCN1CC=C(c2ccc3c(c2)CC(C)(C)CC3)CC1
InChIInChI=1S/C18H25N/c1-18(2)9-6-14-4-5-16(12-17(14)13-18)15-7-10-19(3)11-8-15/h4-5,7,12H,6,8-11,13H2,1-3H3
InChIKeyCGRCNFIXJZLGCI-UHFFFAOYSA-N
XLogP3.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine?
The IUPAC name of 4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine (CID 167678389) is 4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine?
The canonical SMILES for 4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine is CN1CC=C(c2ccc3c(c2)CC(C)(C)CC3)CC1.
What is the InChIKey of 4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine?
The InChIKey is CGRCNFIXJZLGCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N/c1-18(2)9-6-14-4-5-16(12-17(14)13-18)15-7-10-19(3)11-8-15/h4-5,7,12H,6,8-11,13H2,1-3H3.
What are the key properties of 4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine?
4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine has a molecular weight of 255.40 g/mol, XLogP of 3.92, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7,7-dimethyl-6,8-dihydro-5H-naphthalen-2-yl)-1-methyl-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 167678389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).