N-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide

C15H25NO2 — CID 113402760

IUPACN-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide
SMILESC[C@H](CO)NC(=O)C12CC3CC(CC(C)(C3)C1)C2
InChIInChI=1S/C15H25NO2/c1-10(8-17)16-13(18)15-6-11-3-12(7-15)5-14(2,4-11)9-15/h10-12,17H,3-9H2,1-2H3,(H,16,18)/t10-,11?,12?,14?,15?/m1/s1
InChIKeyIHSLVKFLHIUAOT-NAJBLILTSA-N
MW251.37 g/mol
LogP2.09
Rot. Bonds3

About N-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide

N-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide (PubChem CID 113402760) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is N-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide
PubChem CID113402760
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC NameN-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide
SMILESC[C@H](CO)NC(=O)C12CC3CC(CC(C)(C3)C1)C2
InChIInChI=1S/C15H25NO2/c1-10(8-17)16-13(18)15-6-11-3-12(7-15)5-14(2,4-11)9-15/h10-12,17H,3-9H2,1-2H3,(H,16,18)/t10-,11?,12?,14?,15?/m1/s1
InChIKeyIHSLVKFLHIUAOT-NAJBLILTSA-N
XLogP2.09
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide 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-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide?
The IUPAC name of N-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide (CID 113402760) is N-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide.
What is the SMILES notation for N-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide?
The canonical SMILES for N-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide is C[C@H](CO)NC(=O)C12CC3CC(CC(C)(C3)C1)C2.
What is the InChIKey of N-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide?
The InChIKey is IHSLVKFLHIUAOT-NAJBLILTSA-N. The full InChI is InChI=1S/C15H25NO2/c1-10(8-17)16-13(18)15-6-11-3-12(7-15)5-14(2,4-11)9-15/h10-12,17H,3-9H2,1-2H3,(H,16,18)/t10-,11?,12?,14?,15?/m1/s1.
What are the key properties of N-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide?
N-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide has a molecular weight of 251.37 g/mol, XLogP of 2.09, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-hydroxypropan-2-yl]-3-methyladamantane-1-carboxamide is sourced from PubChem (CID 113402760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).