(2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine

C10H20N2 — CID 59885943

IUPAC(2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine
SMILESCC1=CN(C)[C@@H](C)[C@H](N(C)C)C1
InChIInChI=1S/C10H20N2/c1-8-6-10(11(3)4)9(2)12(5)7-8/h7,9-10H,6H2,1-5H3/t9-,10+/m0/s1
InChIKeySSHPOWYNHMLKAL-VHSXEESVSA-N
MW168.28 g/mol
LogP1.54
Rot. Bonds1

About (2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine

(2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine (PubChem CID 59885943) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is (2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine.

Molecular Properties

Compound Name(2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine
PubChem CID59885943
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name(2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine
SMILESCC1=CN(C)[C@@H](C)[C@H](N(C)C)C1
InChIInChI=1S/C10H20N2/c1-8-6-10(11(3)4)9(2)12(5)7-8/h7,9-10H,6H2,1-5H3/t9-,10+/m0/s1
InChIKeySSHPOWYNHMLKAL-VHSXEESVSA-N
XLogP1.54
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine?
The IUPAC name of (2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine (CID 59885943) is (2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine.
What is the SMILES notation for (2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine?
The canonical SMILES for (2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine is CC1=CN(C)[C@@H](C)[C@H](N(C)C)C1.
What is the InChIKey of (2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine?
The InChIKey is SSHPOWYNHMLKAL-VHSXEESVSA-N. The full InChI is InChI=1S/C10H20N2/c1-8-6-10(11(3)4)9(2)12(5)7-8/h7,9-10H,6H2,1-5H3/t9-,10+/m0/s1.
What are the key properties of (2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine?
(2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine has a molecular weight of 168.28 g/mol, XLogP of 1.54, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3R)-N,N,1,2,5-pentamethyl-3,4-dihydro-2H-pyridin-3-amine is sourced from PubChem (CID 59885943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).