N,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine

C11H18N2O — CID 3025107

IUPACN,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine
SMILESCC(COCc1cccnc1)N(C)C
InChIInChI=1S/C11H18N2O/c1-10(13(2)3)8-14-9-11-5-4-6-12-7-11/h4-7,10H,8-9H2,1-3H3
InChIKeyDEFXBODZFIAWSS-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.55
Rot. Bonds5

About N,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine

N,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine (PubChem CID 3025107) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is N,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine
PubChem CID3025107
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC NameN,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine
SMILESCC(COCc1cccnc1)N(C)C
InChIInChI=1S/C11H18N2O/c1-10(13(2)3)8-14-9-11-5-4-6-12-7-11/h4-7,10H,8-9H2,1-3H3
InChIKeyDEFXBODZFIAWSS-UHFFFAOYSA-N
XLogP1.55
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine?
The IUPAC name of N,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine (CID 3025107) is N,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine.
What is the SMILES notation for N,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine?
The canonical SMILES for N,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine is CC(COCc1cccnc1)N(C)C.
What is the InChIKey of N,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine?
The InChIKey is DEFXBODZFIAWSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-10(13(2)3)8-14-9-11-5-4-6-12-7-11/h4-7,10H,8-9H2,1-3H3.
What are the key properties of N,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine?
N,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine has a molecular weight of 194.28 g/mol, XLogP of 1.55, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(pyridin-3-ylmethoxy)propan-2-amine is sourced from PubChem (CID 3025107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).