N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide

C14H23N3O2 — CID 7090487

IUPACN-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide
SMILESC[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NN
InChIInChI=1S/C14H23N3O2/c1-8(12(18)17-15)16-13(19)14-5-9-2-10(6-14)4-11(3-9)7-14/h8-11H,2-7,15H2,1H3,(H,16,19)(H,17,18)/t8-,9?,10?,11?,14?/m1/s1
InChIKeyYHQMTTIZEZVLEN-MTXFGMJDSA-N
MW265.36 g/mol
LogP0.70
Rot. Bonds3

About N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide

N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide (PubChem CID 7090487) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide
PubChem CID7090487
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC NameN-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide
SMILESC[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NN
InChIInChI=1S/C14H23N3O2/c1-8(12(18)17-15)16-13(19)14-5-9-2-10(6-14)4-11(3-9)7-14/h8-11H,2-7,15H2,1H3,(H,16,19)(H,17,18)/t8-,9?,10?,11?,14?/m1/s1
InChIKeyYHQMTTIZEZVLEN-MTXFGMJDSA-N
XLogP0.70
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide
CID 7432877
N-[1-(tert-butylamino)-1-oxopropan-2-yl]adamantane-1-carboxamide
CID 3344892
N-[(2R)-1-oxo-1-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)amino]propan-2-yl]adamantane-1-carboxamide
CID 25481046
N-[1-(4-methylanilino)-1-oxopropan-2-yl]adamantane-1-carboxamide
CID 5229641
N-[(1R)-1-(1-adamantyl)ethyl]adamantane-1-carboxamide
CID 7065184
N-[(2S)-1-(3-bromoanilino)-1-oxopropan-2-yl]adamantane-1-carboxamide
CID 9038662
N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]adamantane-1-carboxamide
CID 7149964
N-[(2R)-1-(4-iodoanilino)-1-oxopropan-2-yl]adamantane-1-carboxamide
CID 29404544
N-[(2S)-1-[2-(4-chlorobenzoyl)hydrazinyl]-1-oxopropan-2-yl]adamantane-1-carboxamide
CID 9206826
N'-(2-methylpropanoyl)adamantane-1-carbohydrazide
CID 2869304
N-propan-2-ylbicyclo[1.1.1]pentane-1-carboxamide
CID 146427466
N-[(2S)-1-[2-[[(2R)-1-methoxypropan-2-yl]carbamothioyl]hydrazinyl]-1-oxopropan-2-yl]adamantane-1-carboxamide
CID 9367467

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide?
The IUPAC name of N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide (CID 7090487) is N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide.
What is the SMILES notation for N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide?
The canonical SMILES for N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide is C[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NN.
What is the InChIKey of N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide?
The InChIKey is YHQMTTIZEZVLEN-MTXFGMJDSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-8(12(18)17-15)16-13(19)14-5-9-2-10(6-14)4-11(3-9)7-14/h8-11H,2-7,15H2,1H3,(H,16,19)(H,17,18)/t8-,9?,10?,11?,14?/m1/s1.
What are the key properties of N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide?
N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 0.70, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide is sourced from PubChem (CID 7090487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).