N-hex-5-en-2-yladamantan-2-amine

C16H27N — CID 104655524

IUPACN-hex-5-en-2-yladamantan-2-amine
SMILESC=CCCC(C)NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C16H27N/c1-3-4-5-11(2)17-16-14-7-12-6-13(9-14)10-15(16)8-12/h3,11-17H,1,4-10H2,2H3
InChIKeySRLIFWPRWIJEIW-UHFFFAOYSA-N
MW233.40 g/mol
LogP3.76
Rot. Bonds5

About N-hex-5-en-2-yladamantan-2-amine

N-hex-5-en-2-yladamantan-2-amine (PubChem CID 104655524) has the molecular formula C16H27N and a molecular weight of 233.40 g/mol. Its IUPAC name is N-hex-5-en-2-yladamantan-2-amine.

Molecular Properties

Compound NameN-hex-5-en-2-yladamantan-2-amine
PubChem CID104655524
Molecular FormulaC16H27N
Molecular Weight233.40 g/mol
Exact Mass233.21
IUPAC NameN-hex-5-en-2-yladamantan-2-amine
SMILESC=CCCC(C)NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C16H27N/c1-3-4-5-11(2)17-16-14-7-12-6-13(9-14)10-15(16)8-12/h3,11-17H,1,4-10H2,2H3
InChIKeySRLIFWPRWIJEIW-UHFFFAOYSA-N
XLogP3.76
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.40
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-hex-5-en-2-ylcyclopropanamine
CID 104581323
N-hex-5-en-2-ylcyclopent-3-en-1-amine
CID 104582994
4-(hex-5-en-2-ylamino)cyclohexan-1-ol
CID 75525485
4-N-(2-adamantyl)-1-N,1-N-diethylpentane-1,4-diamine
CID 43406667
N-hex-5-en-2-yloxetan-3-amine
CID 104655767
N-(4,4,4-trifluorobutan-2-yl)adamantan-2-amine
CID 113260616
N-hex-5-en-2-yl-4-methylcyclohexan-1-amine
CID 104581515
1-(2-adamantylamino)ethanol
CID 142760557
N-hex-5-en-2-yloxan-4-amine
CID 104581845
2-cyclopropyl-N-hex-5-en-2-yloxolan-3-amine
CID 104583626
N-(1-pyrrolidin-2-ylpropan-2-yl)adamantan-2-amine
CID 79540152
N-hex-5-en-2-yl-1-methylpiperidin-4-amine
CID 75525498

Frequently Asked Questions

What is the IUPAC name of N-hex-5-en-2-yladamantan-2-amine?
The IUPAC name of N-hex-5-en-2-yladamantan-2-amine (CID 104655524) is N-hex-5-en-2-yladamantan-2-amine.
What is the SMILES notation for N-hex-5-en-2-yladamantan-2-amine?
The canonical SMILES for N-hex-5-en-2-yladamantan-2-amine is C=CCCC(C)NC1C2CC3CC(C2)CC1C3.
What is the InChIKey of N-hex-5-en-2-yladamantan-2-amine?
The InChIKey is SRLIFWPRWIJEIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N/c1-3-4-5-11(2)17-16-14-7-12-6-13(9-14)10-15(16)8-12/h3,11-17H,1,4-10H2,2H3.
What are the key properties of N-hex-5-en-2-yladamantan-2-amine?
N-hex-5-en-2-yladamantan-2-amine has a molecular weight of 233.40 g/mol, XLogP of 3.76, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-hex-5-en-2-yladamantan-2-amine is sourced from PubChem (CID 104655524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).