9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide

C13H22N2O — CID 120983734

IUPAC9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide
SMILESNC1C2CCCC1CC(C(=O)NC1CC1)C2
InChIInChI=1S/C13H22N2O/c14-12-8-2-1-3-9(12)7-10(6-8)13(16)15-11-4-5-11/h8-12H,1-7,14H2,(H,15,16)
InChIKeyFSSYXCWFOHATAF-UHFFFAOYSA-N
MW222.33 g/mol
LogP1.42
Rot. Bonds2

About 9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide

9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide (PubChem CID 120983734) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is 9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide.

Molecular Properties

Compound Name9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide
PubChem CID120983734
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide
SMILESNC1C2CCCC1CC(C(=O)NC1CC1)C2
InChIInChI=1S/C13H22N2O/c14-12-8-2-1-3-9(12)7-10(6-8)13(16)15-11-4-5-11/h8-12H,1-7,14H2,(H,15,16)
InChIKeyFSSYXCWFOHATAF-UHFFFAOYSA-N
XLogP1.42
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

9-amino-N-(3,5-dimethylcyclohexyl)bicyclo[3.3.1]nonane-3-carboxamide
CID 120990552
9-amino-N-propan-2-ylbicyclo[3.3.1]nonane-3-carboxamide
CID 120983266
3-amino-N-cyclopropylcyclohexane-1-carboxamide
CID 18071393
9-amino-N-[(1S,2R,4R)-7-oxabicyclo[2.2.1]heptan-2-yl]bicyclo[3.3.1]nonane-3-carboxamide
CID 120990013
9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide
CID 120984863
9-amino-N-(2-methoxycyclohexyl)bicyclo[3.3.1]nonane-3-carboxamide
CID 120990988
9-amino-N-(3,4-dihydro-2H-chromen-3-yl)bicyclo[3.3.1]nonane-3-carboxamide
CID 120985986
9-amino-N-(2,2,2-trifluoroethyl)bicyclo[3.3.1]nonane-3-carboxamide
CID 120985035
9-amino-N-[2-(2-methylpropyl)oxan-4-yl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120994125
3-amino-N-cyclobutylbicyclo[2.2.1]heptane-2-carboxamide;hydrochloride
CID 119726919
9-amino-N-(3-amino-3-oxopropyl)bicyclo[3.3.1]nonane-3-carboxamide
CID 120986072
9-amino-N-[1-(pyridin-3-ylmethyl)piperidin-4-yl]bicyclo[3.3.1]nonane-3-carboxamide
CID 120989928

Frequently Asked Questions

What is the IUPAC name of 9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide?
The IUPAC name of 9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide (CID 120983734) is 9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide.
What is the SMILES notation for 9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide?
The canonical SMILES for 9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide is NC1C2CCCC1CC(C(=O)NC1CC1)C2.
What is the InChIKey of 9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide?
The InChIKey is FSSYXCWFOHATAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c14-12-8-2-1-3-9(12)7-10(6-8)13(16)15-11-4-5-11/h8-12H,1-7,14H2,(H,15,16).
What are the key properties of 9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide?
9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide has a molecular weight of 222.33 g/mol, XLogP of 1.42, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-amino-N-cyclopropylbicyclo[3.3.1]nonane-3-carboxamide is sourced from PubChem (CID 120983734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).