1-(1-adamantylamino)-2-methylpropan-2-ol

C14H25NO — CID 60884429

IUPAC1-(1-adamantylamino)-2-methylpropan-2-ol
SMILESCC(C)(O)CNC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C14H25NO/c1-13(2,16)9-15-14-6-10-3-11(7-14)5-12(4-10)8-14/h10-12,15-16H,3-9H2,1-2H3
InChIKeyHZVBDZPTWBDIRV-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.32
Rot. Bonds3

About 1-(1-adamantylamino)-2-methylpropan-2-ol

1-(1-adamantylamino)-2-methylpropan-2-ol (PubChem CID 60884429) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 1-(1-adamantylamino)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(1-adamantylamino)-2-methylpropan-2-ol
PubChem CID60884429
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name1-(1-adamantylamino)-2-methylpropan-2-ol
SMILESCC(C)(O)CNC12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C14H25NO/c1-13(2,16)9-15-14-6-10-3-11(7-14)5-12(4-10)8-14/h10-12,15-16H,3-9H2,1-2H3
InChIKeyHZVBDZPTWBDIRV-UHFFFAOYSA-N
XLogP2.32
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-Adamantylamino)propan-2-ol
CID 4240030
2-(1-Adamantylamino)ethanol
CID 437855
2-[(3,5-Dimethyl-1-adamantyl)amino]ethanol
CID 23009218
2-[(3-Methyl-1-adamantyl)amino]ethanol
CID 303797
N-(2-methoxyethyl)adamantan-1-amine
CID 23009187
1-(1-Adamantylamino)propan-2-ol hydrochloride
CID 24721679
1-(1-Adamantylamino)ethanol
CID 54280280
2-(1-Adamantylamino)propan-2-ol
CID 58571389
1-[(3,5-Dimethyl-1-adamantyl)amino]propan-2-ol
CID 79997666
1-[(4-Amino-1-adamantyl)amino]-2-methylpropan-2-ol
CID 141346144
1-(1-Adamantylamino)propan-1-ol
CID 166559217
N-ethyladamantan-1-amine;hydrate
CID 173851672

Frequently Asked Questions

What is the IUPAC name of 1-(1-adamantylamino)-2-methylpropan-2-ol?
The IUPAC name of 1-(1-adamantylamino)-2-methylpropan-2-ol (CID 60884429) is 1-(1-adamantylamino)-2-methylpropan-2-ol.
What is the SMILES notation for 1-(1-adamantylamino)-2-methylpropan-2-ol?
The canonical SMILES for 1-(1-adamantylamino)-2-methylpropan-2-ol is CC(C)(O)CNC12CC3CC(CC(C3)C1)C2.
What is the InChIKey of 1-(1-adamantylamino)-2-methylpropan-2-ol?
The InChIKey is HZVBDZPTWBDIRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-13(2,16)9-15-14-6-10-3-11(7-14)5-12(4-10)8-14/h10-12,15-16H,3-9H2,1-2H3.
What are the key properties of 1-(1-adamantylamino)-2-methylpropan-2-ol?
1-(1-adamantylamino)-2-methylpropan-2-ol has a molecular weight of 223.36 g/mol, XLogP of 2.32, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-adamantylamino)-2-methylpropan-2-ol is sourced from PubChem (CID 60884429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).