(8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine

C10H19N — CID 139244972

IUPAC(8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
SMILESNC1CCC2CCCC[C@@H]2C1
InChIInChI=1S/C10H19N/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-10H,1-7,11H2/t8?,9-,10?/m1/s1
InChIKeyFFROQSBSJYRALS-HWOCKDDLSA-N
MW153.27 g/mol
LogP2.30
Rot. Bonds

About (8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine

(8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine (PubChem CID 139244972) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is (8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine.

Molecular Properties

Compound Name(8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
PubChem CID139244972
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name(8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
SMILESNC1CCC2CCCC[C@@H]2C1
InChIInChI=1S/C10H19N/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-10H,1-7,11H2/t8?,9-,10?/m1/s1
InChIKeyFFROQSBSJYRALS-HWOCKDDLSA-N
XLogP2.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine?
The IUPAC name of (8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine (CID 139244972) is (8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine.
What is the SMILES notation for (8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine?
The canonical SMILES for (8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine is NC1CCC2CCCC[C@@H]2C1.
What is the InChIKey of (8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine?
The InChIKey is FFROQSBSJYRALS-HWOCKDDLSA-N. The full InChI is InChI=1S/C10H19N/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-10H,1-7,11H2/t8?,9-,10?/m1/s1.
What are the key properties of (8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine?
(8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine has a molecular weight of 153.27 g/mol, XLogP of 2.30, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (8aR)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine is sourced from PubChem (CID 139244972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).