(2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine

C8H14N2 — CID 67991661

IUPAC(2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine
SMILESC[C@@H]1N=CC=CC1N(C)C
InChIInChI=1S/C8H14N2/c1-7-8(10(2)3)5-4-6-9-7/h4-8H,1-3H3/t7-,8?/m0/s1
InChIKeyHBJJUBYFOLSHBN-JAMMHHFISA-N
MW138.21 g/mol
LogP0.95
Rot. Bonds1

About (2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine

(2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine (PubChem CID 67991661) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is (2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine.

Molecular Properties

Compound Name(2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine
PubChem CID67991661
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name(2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine
SMILESC[C@@H]1N=CC=CC1N(C)C
InChIInChI=1S/C8H14N2/c1-7-8(10(2)3)5-4-6-9-7/h4-8H,1-3H3/t7-,8?/m0/s1
InChIKeyHBJJUBYFOLSHBN-JAMMHHFISA-N
XLogP0.95
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine?
The IUPAC name of (2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine (CID 67991661) is (2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine.
What is the SMILES notation for (2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine?
The canonical SMILES for (2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine is C[C@@H]1N=CC=CC1N(C)C.
What is the InChIKey of (2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine?
The InChIKey is HBJJUBYFOLSHBN-JAMMHHFISA-N. The full InChI is InChI=1S/C8H14N2/c1-7-8(10(2)3)5-4-6-9-7/h4-8H,1-3H3/t7-,8?/m0/s1.
What are the key properties of (2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine?
(2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine has a molecular weight of 138.21 g/mol, XLogP of 0.95, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N,N,2-trimethyl-2,3-dihydropyridin-3-amine is sourced from PubChem (CID 67991661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).