N,N-diethyladamantan-1-amine

C14H25N — CID 3010119

IUPACN,N-diethyladamantan-1-amine
SMILESCCN(CC)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C14H25N/c1-3-15(4-2)14-8-11-5-12(9-14)7-13(6-11)10-14/h11-13H,3-10H2,1-2H3
InChIKeyGJOSMKOKKDLWKH-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.30
Rot. Bonds3

About N,N-diethyladamantan-1-amine

N,N-diethyladamantan-1-amine (PubChem CID 3010119) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is N,N-diethyladamantan-1-amine.

Molecular Properties

Compound NameN,N-diethyladamantan-1-amine
PubChem CID3010119
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC NameN,N-diethyladamantan-1-amine
SMILESCCN(CC)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C14H25N/c1-3-15(4-2)14-8-11-5-12(9-14)7-13(6-11)10-14/h11-13H,3-10H2,1-2H3
InChIKeyGJOSMKOKKDLWKH-UHFFFAOYSA-N
XLogP3.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-dimethyl-1-adamantanamine
CID 19478
Tricyclo(3.3.1.1 3,7)decan-1-aminium, N,N,N-trimethyl-, chloride (1:1)
CID 10966295
N-Ethyladamantan-1-amine
CID 19480
Tricyclo(3.3.1.13,7)decan-1-aminium, N,N,N-trimethyl-, hydroxide (1:1)
CID 14475644
1-Adamantyl(trimethyl)ammonium
CID 3010127
CID 5276624
CID 5276624
Tricyclo(3.3.1.1(3,7))decan-1-amine, N-(1-methylethyl)-
CID 19332
2-N,N-dimethylaminoadamantane
CID 25340
1-Adamantanamine, N-ethyl-, hydrochloride
CID 19479
1-Adamantanamine, N-propyl-, hydrochloride
CID 19481
2-Adamantanamine, N,N-dimethyl-, hydrochloride
CID 25339
Adamantane, 1-(3-dimethylaminopropyl)-, hydrochloride
CID 36005

Frequently Asked Questions

What is the IUPAC name of N,N-diethyladamantan-1-amine?
The IUPAC name of N,N-diethyladamantan-1-amine (CID 3010119) is N,N-diethyladamantan-1-amine.
What is the SMILES notation for N,N-diethyladamantan-1-amine?
The canonical SMILES for N,N-diethyladamantan-1-amine is CCN(CC)C12CC3CC(CC(C3)C1)C2.
What is the InChIKey of N,N-diethyladamantan-1-amine?
The InChIKey is GJOSMKOKKDLWKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-3-15(4-2)14-8-11-5-12(9-14)7-13(6-11)10-14/h11-13H,3-10H2,1-2H3.
What are the key properties of N,N-diethyladamantan-1-amine?
N,N-diethyladamantan-1-amine has a molecular weight of 207.36 g/mol, XLogP of 3.30, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyladamantan-1-amine is sourced from PubChem (CID 3010119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).