2-(cyclopropylamino)adamantane-2-carboxamide

C14H22N2O — CID 62778788

IUPAC2-(cyclopropylamino)adamantane-2-carboxamide
SMILESNC(=O)C1(NC2CC2)C2CC3CC(C2)CC1C3
InChIInChI=1S/C14H22N2O/c15-13(17)14(16-12-1-2-12)10-4-8-3-9(6-10)7-11(14)5-8/h8-12,16H,1-7H2,(H2,15,17)
InChIKeyWTQGKUXMJMHDSU-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.42
Rot. Bonds3

About 2-(cyclopropylamino)adamantane-2-carboxamide

2-(cyclopropylamino)adamantane-2-carboxamide (PubChem CID 62778788) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(cyclopropylamino)adamantane-2-carboxamide.

Molecular Properties

Compound Name2-(cyclopropylamino)adamantane-2-carboxamide
PubChem CID62778788
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-(cyclopropylamino)adamantane-2-carboxamide
SMILESNC(=O)C1(NC2CC2)C2CC3CC(C2)CC1C3
InChIInChI=1S/C14H22N2O/c15-13(17)14(16-12-1-2-12)10-4-8-3-9(6-10)7-11(14)5-8/h8-12,16H,1-7H2,(H2,15,17)
InChIKeyWTQGKUXMJMHDSU-UHFFFAOYSA-N
XLogP1.42
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(cyclopropylamino)adamantane-2-carboxylic acid
CID 62778949
ethyl 2-(cyclopropylamino)adamantane-2-carboxylate
CID 62780818
ethyl 2-(cyclopentylamino)adamantane-2-carboxylate
CID 62772538
2-(4-chloroanilino)adamantane-2-carboxamide
CID 62780802
2-(cyclopropylamino)bicyclo[2.2.2]octane-2-carboxamide
CID 130905435
2-acetamidoadamantane-2-carboxylic acid
CID 15322577
adamantane;urea
CID 68761520
1-(cyclopropylamino)cyclooctane-1-carboxamide
CID 60795922
ethyl 2-(methylamino)adamantane-2-carboxylate
CID 62778952
methyl (2S)-2-[(2-carbamoyl-2-adamantyl)amino]-3-phenylpropanoate
CID 53388213
1-(cyclopropylamino)-3,3,5,5-tetramethylcyclohexane-1-carboxamide
CID 112682408
1-(cyclopentylamino)cyclopropane-1-carboxamide
CID 103950092

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)adamantane-2-carboxamide?
The IUPAC name of 2-(cyclopropylamino)adamantane-2-carboxamide (CID 62778788) is 2-(cyclopropylamino)adamantane-2-carboxamide.
What is the SMILES notation for 2-(cyclopropylamino)adamantane-2-carboxamide?
The canonical SMILES for 2-(cyclopropylamino)adamantane-2-carboxamide is NC(=O)C1(NC2CC2)C2CC3CC(C2)CC1C3.
What is the InChIKey of 2-(cyclopropylamino)adamantane-2-carboxamide?
The InChIKey is WTQGKUXMJMHDSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c15-13(17)14(16-12-1-2-12)10-4-8-3-9(6-10)7-11(14)5-8/h8-12,16H,1-7H2,(H2,15,17).
What are the key properties of 2-(cyclopropylamino)adamantane-2-carboxamide?
2-(cyclopropylamino)adamantane-2-carboxamide has a molecular weight of 234.34 g/mol, XLogP of 1.42, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)adamantane-2-carboxamide is sourced from PubChem (CID 62778788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).