(6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine

C9H18N2 — CID 170600728

IUPAC(6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine
SMILESCC(C)C1=C[C@@H](C)N(N)CC1
InChIInChI=1S/C9H18N2/c1-7(2)9-4-5-11(10)8(3)6-9/h6-8H,4-5,10H2,1-3H3/t8-/m1/s1
InChIKeyWKOLDAVVXNXQRI-MRVPVSSYSA-N
MW154.26 g/mol
LogP1.54
Rot. Bonds1

About (6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine

(6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine (PubChem CID 170600728) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is (6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine.

Molecular Properties

Compound Name(6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine
PubChem CID170600728
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name(6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine
SMILESCC(C)C1=C[C@@H](C)N(N)CC1
InChIInChI=1S/C9H18N2/c1-7(2)9-4-5-11(10)8(3)6-9/h6-8H,4-5,10H2,1-3H3/t8-/m1/s1
InChIKeyWKOLDAVVXNXQRI-MRVPVSSYSA-N
XLogP1.54
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine?
The IUPAC name of (6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine (CID 170600728) is (6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine.
What is the SMILES notation for (6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine?
The canonical SMILES for (6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine is CC(C)C1=C[C@@H](C)N(N)CC1.
What is the InChIKey of (6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine?
The InChIKey is WKOLDAVVXNXQRI-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H18N2/c1-7(2)9-4-5-11(10)8(3)6-9/h6-8H,4-5,10H2,1-3H3/t8-/m1/s1.
What are the key properties of (6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine?
(6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine has a molecular weight of 154.26 g/mol, XLogP of 1.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-methyl-4-propan-2-yl-3,6-dihydro-2H-pyridin-1-amine is sourced from PubChem (CID 170600728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).