(3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine

C9H18N2 — CID 126583082

IUPAC(3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine
SMILESCC1C=CN(C)C(C)(C)[C@H]1N
InChIInChI=1S/C9H18N2/c1-7-5-6-11(4)9(2,3)8(7)10/h5-8H,10H2,1-4H3/t7?,8-/m0/s1
InChIKeySTKQISWEONMBMZ-MQWKRIRWSA-N
MW154.26 g/mol
LogP1.19
Rot. Bonds

About (3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine

(3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine (PubChem CID 126583082) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is (3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine.

Molecular Properties

Compound Name(3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine
PubChem CID126583082
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name(3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine
SMILESCC1C=CN(C)C(C)(C)[C@H]1N
InChIInChI=1S/C9H18N2/c1-7-5-6-11(4)9(2,3)8(7)10/h5-8H,10H2,1-4H3/t7?,8-/m0/s1
InChIKeySTKQISWEONMBMZ-MQWKRIRWSA-N
XLogP1.19
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine?
The IUPAC name of (3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine (CID 126583082) is (3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine.
What is the SMILES notation for (3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine?
The canonical SMILES for (3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine is CC1C=CN(C)C(C)(C)[C@H]1N.
What is the InChIKey of (3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine?
The InChIKey is STKQISWEONMBMZ-MQWKRIRWSA-N. The full InChI is InChI=1S/C9H18N2/c1-7-5-6-11(4)9(2,3)8(7)10/h5-8H,10H2,1-4H3/t7?,8-/m0/s1.
What are the key properties of (3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine?
(3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine has a molecular weight of 154.26 g/mol, XLogP of 1.19, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1,2,2,4-tetramethyl-3,4-dihydropyridin-3-amine is sourced from PubChem (CID 126583082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).