2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine

C11H18N2 — CID 62395550

IUPAC2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine
SMILESCc1cccnc1C(N)C(C)(C)C
InChIInChI=1S/C11H18N2/c1-8-6-5-7-13-9(8)10(12)11(2,3)4/h5-7,10H,12H2,1-4H3
InChIKeyYYCWWTRKRRLKER-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.44
Rot. Bonds1

About 2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine

2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine (PubChem CID 62395550) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine
PubChem CID62395550
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine
SMILESCc1cccnc1C(N)C(C)(C)C
InChIInChI=1S/C11H18N2/c1-8-6-5-7-13-9(8)10(12)11(2,3)4/h5-7,10H,12H2,1-4H3
InChIKeyYYCWWTRKRRLKER-UHFFFAOYSA-N
XLogP2.44
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine?
The IUPAC name of 2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine (CID 62395550) is 2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine.
What is the SMILES notation for 2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine?
The canonical SMILES for 2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine is Cc1cccnc1C(N)C(C)(C)C.
What is the InChIKey of 2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine?
The InChIKey is YYCWWTRKRRLKER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-8-6-5-7-13-9(8)10(12)11(2,3)4/h5-7,10H,12H2,1-4H3.
What are the key properties of 2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine?
2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine has a molecular weight of 178.28 g/mol, XLogP of 2.44, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-(3-methyl-2-pyridinyl)propan-1-amine is sourced from PubChem (CID 62395550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).