(3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine

C10H19N — CID 166981632

IUPAC(3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine
SMILESCCC[C@H]1CN(C)C=CC1C
InChIInChI=1S/C10H19N/c1-4-5-10-8-11(3)7-6-9(10)2/h6-7,9-10H,4-5,8H2,1-3H3/t9?,10-/m0/s1
InChIKeyQKPCTEMBUQNKES-AXDSSHIGSA-N
MW153.27 g/mol
LogP2.50
Rot. Bonds2

About (3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine

(3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine (PubChem CID 166981632) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is (3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine.

Molecular Properties

Compound Name(3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine
PubChem CID166981632
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name(3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine
SMILESCCC[C@H]1CN(C)C=CC1C
InChIInChI=1S/C10H19N/c1-4-5-10-8-11(3)7-6-9(10)2/h6-7,9-10H,4-5,8H2,1-3H3/t9?,10-/m0/s1
InChIKeyQKPCTEMBUQNKES-AXDSSHIGSA-N
XLogP2.50
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine?
The IUPAC name of (3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine (CID 166981632) is (3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine.
What is the SMILES notation for (3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine?
The canonical SMILES for (3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine is CCC[C@H]1CN(C)C=CC1C.
What is the InChIKey of (3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine?
The InChIKey is QKPCTEMBUQNKES-AXDSSHIGSA-N. The full InChI is InChI=1S/C10H19N/c1-4-5-10-8-11(3)7-6-9(10)2/h6-7,9-10H,4-5,8H2,1-3H3/t9?,10-/m0/s1.
What are the key properties of (3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine?
(3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine has a molecular weight of 153.27 g/mol, XLogP of 2.50, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1,4-dimethyl-3-propyl-3,4-dihydro-2H-pyridine is sourced from PubChem (CID 166981632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).