N,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine

C13H24N2 — CID 139538970

IUPACN,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine
SMILESCCN(CC)C1=CN(C)C(C(C)C)C=C1
InChIInChI=1S/C13H24N2/c1-6-15(7-2)12-8-9-13(11(3)4)14(5)10-12/h8-11,13H,6-7H2,1-5H3
InChIKeyVQHTUJFKFAUOGE-UHFFFAOYSA-N
MW208.35 g/mol
LogP2.70
Rot. Bonds4

About N,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine

N,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine (PubChem CID 139538970) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is N,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine.

Molecular Properties

Compound NameN,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine
PubChem CID139538970
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC NameN,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine
SMILESCCN(CC)C1=CN(C)C(C(C)C)C=C1
InChIInChI=1S/C13H24N2/c1-6-15(7-2)12-8-9-13(11(3)4)14(5)10-12/h8-11,13H,6-7H2,1-5H3
InChIKeyVQHTUJFKFAUOGE-UHFFFAOYSA-N
XLogP2.70
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine?
The IUPAC name of N,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine (CID 139538970) is N,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine.
What is the SMILES notation for N,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine?
The canonical SMILES for N,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine is CCN(CC)C1=CN(C)C(C(C)C)C=C1.
What is the InChIKey of N,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine?
The InChIKey is VQHTUJFKFAUOGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2/c1-6-15(7-2)12-8-9-13(11(3)4)14(5)10-12/h8-11,13H,6-7H2,1-5H3.
What are the key properties of N,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine?
N,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine has a molecular weight of 208.35 g/mol, XLogP of 2.70, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-methyl-2-propan-2-yl-2H-pyridin-5-amine is sourced from PubChem (CID 139538970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).