N-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine

C13H23N — CID 43222904

IUPACN-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
SMILESC1CCC2CC(NC3CC3)CCC2C1
InChIInChI=1S/C13H23N/c1-2-4-11-9-13(14-12-7-8-12)6-5-10(11)3-1/h10-14H,1-9H2
InChIKeyXCNCAEWQGBRZFA-UHFFFAOYSA-N
MW193.33 g/mol
LogP3.10
Rot. Bonds2

About N-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine

N-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine (PubChem CID 43222904) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is N-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
PubChem CID43222904
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC NameN-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine
SMILESC1CCC2CC(NC3CC3)CCC2C1
InChIInChI=1S/C13H23N/c1-2-4-11-9-13(14-12-7-8-12)6-5-10(11)3-1/h10-14H,1-9H2
InChIKeyXCNCAEWQGBRZFA-UHFFFAOYSA-N
XLogP3.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine?
The IUPAC name of N-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine (CID 43222904) is N-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine.
What is the SMILES notation for N-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine?
The canonical SMILES for N-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine is C1CCC2CC(NC3CC3)CCC2C1.
What is the InChIKey of N-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine?
The InChIKey is XCNCAEWQGBRZFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N/c1-2-4-11-9-13(14-12-7-8-12)6-5-10(11)3-1/h10-14H,1-9H2.
What are the key properties of N-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine?
N-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine has a molecular weight of 193.33 g/mol, XLogP of 3.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-amine is sourced from PubChem (CID 43222904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).