N,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine

C12H19N3O — CID 23227060

IUPACN,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine
SMILESCNc1cc(OCC2CCCN2)cnc1C
InChIInChI=1S/C12H19N3O/c1-9-12(13-2)6-11(7-15-9)16-8-10-4-3-5-14-10/h6-7,10,13-14H,3-5,8H2,1-2H3
InChIKeyZULLNQCPQZRAOB-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.56
Rot. Bonds4

About N,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine

N,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine (PubChem CID 23227060) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine.

Molecular Properties

Compound NameN,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine
PubChem CID23227060
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine
SMILESCNc1cc(OCC2CCCN2)cnc1C
InChIInChI=1S/C12H19N3O/c1-9-12(13-2)6-11(7-15-9)16-8-10-4-3-5-14-10/h6-7,10,13-14H,3-5,8H2,1-2H3
InChIKeyZULLNQCPQZRAOB-UHFFFAOYSA-N
XLogP1.56
TPSA46.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine?
The IUPAC name of N,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine (CID 23227060) is N,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine.
What is the SMILES notation for N,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine?
The canonical SMILES for N,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine is CNc1cc(OCC2CCCN2)cnc1C.
What is the InChIKey of N,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine?
The InChIKey is ZULLNQCPQZRAOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-9-12(13-2)6-11(7-15-9)16-8-10-4-3-5-14-10/h6-7,10,13-14H,3-5,8H2,1-2H3.
What are the key properties of N,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine?
N,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine has a molecular weight of 221.30 g/mol, XLogP of 1.56, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine is sourced from PubChem (CID 23227060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).