1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine

C8H14N2 — CID 18707117

IUPAC1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine
SMILESCN(C)CC1C=CC=CN1
InChIInChI=1S/C8H14N2/c1-10(2)7-8-5-3-4-6-9-8/h3-6,8-9H,7H2,1-2H3
InChIKeyAATCSPMJPTURGB-UHFFFAOYSA-N
MW138.21 g/mol
LogP0.59
Rot. Bonds2

About 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine

1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine (PubChem CID 18707117) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine
PubChem CID18707117
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine
SMILESCN(C)CC1C=CC=CN1
InChIInChI=1S/C8H14N2/c1-10(2)7-8-5-3-4-6-9-8/h3-6,8-9H,7H2,1-2H3
InChIKeyAATCSPMJPTURGB-UHFFFAOYSA-N
XLogP0.59
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine (CID 18707117) is 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine is CN(C)CC1C=CC=CN1.
What is the InChIKey of 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine?
The InChIKey is AATCSPMJPTURGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-10(2)7-8-5-3-4-6-9-8/h3-6,8-9H,7H2,1-2H3.
What are the key properties of 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine?
1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine has a molecular weight of 138.21 g/mol, XLogP of 0.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-dihydropyridin-2-yl)-N,N-dimethylmethanamine is sourced from PubChem (CID 18707117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).