N-(2-adamantyl)adamantan-2-amine

C20H31N — CID 3725304

IUPACN-(2-adamantyl)adamantan-2-amine
SMILESC1C2CC3CC1CC(C2)C3NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C20H31N/c1-11-3-15-5-12(1)6-16(4-11)19(15)21-20-17-7-13-2-14(9-17)10-18(20)8-13/h11-21H,1-10H2
InChIKeyHIHPVMOIODYXNT-UHFFFAOYSA-N
MW285.47 g/mol
LogP4.23
Rot. Bonds2

About N-(2-adamantyl)adamantan-2-amine

N-(2-adamantyl)adamantan-2-amine (PubChem CID 3725304) has the molecular formula C20H31N and a molecular weight of 285.47 g/mol. Its IUPAC name is N-(2-adamantyl)adamantan-2-amine.

Molecular Properties

Compound NameN-(2-adamantyl)adamantan-2-amine
PubChem CID3725304
Molecular FormulaC20H31N
Molecular Weight285.47 g/mol
Exact Mass285.25
IUPAC NameN-(2-adamantyl)adamantan-2-amine
SMILESC1C2CC3CC1CC(C2)C3NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C20H31N/c1-11-3-15-5-12(1)6-16(4-11)19(15)21-20-17-7-13-2-14(9-17)10-18(20)8-13/h11-21H,1-10H2
InChIKeyHIHPVMOIODYXNT-UHFFFAOYSA-N
XLogP4.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.47
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)adamantan-2-amine?
The IUPAC name of N-(2-adamantyl)adamantan-2-amine (CID 3725304) is N-(2-adamantyl)adamantan-2-amine.
What is the SMILES notation for N-(2-adamantyl)adamantan-2-amine?
The canonical SMILES for N-(2-adamantyl)adamantan-2-amine is C1C2CC3CC1CC(C2)C3NC1C2CC3CC(C2)CC1C3.
What is the InChIKey of N-(2-adamantyl)adamantan-2-amine?
The InChIKey is HIHPVMOIODYXNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N/c1-11-3-15-5-12(1)6-16(4-11)19(15)21-20-17-7-13-2-14(9-17)10-18(20)8-13/h11-21H,1-10H2.
What are the key properties of N-(2-adamantyl)adamantan-2-amine?
N-(2-adamantyl)adamantan-2-amine has a molecular weight of 285.47 g/mol, XLogP of 4.23, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)adamantan-2-amine is sourced from PubChem (CID 3725304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).