9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide

C14H24N2O — CID 120984863

IUPAC9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide
SMILESNC1C2CCCC1CC(C(=O)NCC1CC1)C2
InChIInChI=1S/C14H24N2O/c15-13-10-2-1-3-11(13)7-12(6-10)14(17)16-8-9-4-5-9/h9-13H,1-8,15H2,(H,16,17)
InChIKeyWVSSXEVTHVADDD-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.67
Rot. Bonds3

About 9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide

9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide (PubChem CID 120984863) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide.

Molecular Properties

Compound Name9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide
PubChem CID120984863
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide
SMILESNC1C2CCCC1CC(C(=O)NCC1CC1)C2
InChIInChI=1S/C14H24N2O/c15-13-10-2-1-3-11(13)7-12(6-10)14(17)16-8-9-4-5-9/h9-13H,1-8,15H2,(H,16,17)
InChIKeyWVSSXEVTHVADDD-UHFFFAOYSA-N
XLogP1.67
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

9-amino-N-[2-(cyclopropylmethylamino)-2-oxoethyl]bicyclo[3.3.1]nonane-3-carboxamide
CID 120994182
9-amino-N-[(3-methylcyclohexyl)methyl]bicyclo[3.3.1]nonane-3-carboxamide
CID 120987251
9-amino-N-(oxan-3-ylmethyl)bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120986884
9-amino-N-[2-(cyclopropylmethoxy)ethyl]bicyclo[3.3.1]nonane-3-carboxamide
CID 120989389
N-[(3-aminocyclohexyl)methyl]bicyclo[3.1.0]hexane-3-carboxamide
CID 114146502
9-amino-N-(2,2,2-trifluoroethyl)bicyclo[3.3.1]nonane-3-carboxamide
CID 120985035
9-amino-N-(3-amino-3-oxopropyl)bicyclo[3.3.1]nonane-3-carboxamide
CID 120986072
9-amino-N-[2-(cyclopropylmethylsulfonyl)ethyl]bicyclo[3.3.1]nonane-3-carboxamide
CID 120992972
9-amino-N-(2-chloroprop-2-enyl)bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120990322
9-amino-N-[2-(ethylamino)-2-oxoethyl]bicyclo[3.3.1]nonane-3-carboxamide
CID 120983832
9-amino-N-(2-cyclopentyloxyethyl)bicyclo[3.3.1]nonane-3-carboxamide
CID 120986701
9-amino-N-[(2-propan-2-yloxolan-3-yl)methyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120991798

Frequently Asked Questions

What is the IUPAC name of 9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide?
The IUPAC name of 9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide (CID 120984863) is 9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide.
What is the SMILES notation for 9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide?
The canonical SMILES for 9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide is NC1C2CCCC1CC(C(=O)NCC1CC1)C2.
What is the InChIKey of 9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide?
The InChIKey is WVSSXEVTHVADDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c15-13-10-2-1-3-11(13)7-12(6-10)14(17)16-8-9-4-5-9/h9-13H,1-8,15H2,(H,16,17).
What are the key properties of 9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide?
9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide has a molecular weight of 236.36 g/mol, XLogP of 1.67, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-amino-N-(cyclopropylmethyl)bicyclo[3.3.1]nonane-3-carboxamide is sourced from PubChem (CID 120984863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).