N-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide

C11H20N2O — CID 104872968

IUPACN-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide
SMILESC[C@H](CN)NC(=O)C1C2CCCCC21
InChIInChI=1S/C11H20N2O/c1-7(6-12)13-11(14)10-8-4-2-3-5-9(8)10/h7-10H,2-6,12H2,1H3,(H,13,14)/t7-,8?,9?,10?/m1/s1
InChIKeyFCJXHIJGAAVODB-QVNBGCGHSA-N
MW196.29 g/mol
LogP0.89
Rot. Bonds3

About N-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide

N-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide (PubChem CID 104872968) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide.

Molecular Properties

Compound NameN-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide
PubChem CID104872968
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide
SMILESC[C@H](CN)NC(=O)C1C2CCCCC21
InChIInChI=1S/C11H20N2O/c1-7(6-12)13-11(14)10-8-4-2-3-5-9(8)10/h7-10H,2-6,12H2,1H3,(H,13,14)/t7-,8?,9?,10?/m1/s1
InChIKeyFCJXHIJGAAVODB-QVNBGCGHSA-N
XLogP0.89
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(bicyclo[3.1.0]hexane-6-carbonylamino)butanoic acid
CID 81455937
N-(1-cyanopropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide
CID 79672859
N-(1-amino-3-methoxypropan-2-yl)bicyclo[3.1.0]hexane-6-carboxamide
CID 106180519
N-[(2R)-1-aminopropan-2-yl]oxane-3-carboxamide
CID 104873146
N-[(2S)-1-aminopropan-2-yl]-3-methylcyclohexane-1-carboxamide;hydrochloride
CID 131134215
N-[(2S)-1-aminopropan-2-yl]-2-cycloheptylacetamide
CID 120507495
N-[(2R)-1-hydroxybutan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide
CID 103920219
(2R)-N-[(2S)-1-aminopropan-2-yl]pyrrolidine-2-carboxamide;hydrochloride
CID 130736371
N-[(2S)-1-aminopropan-2-yl]-2-cyclopentyloxyacetamide;hydrochloride
CID 120508345
(3R)-N-[(2R)-1-aminopropan-2-yl]piperidine-3-carboxamide
CID 130710975
N-(2-aminoethyl)bicyclo[4.1.0]heptane-7-carboxamide
CID 81459042
(2S)-2-(bicyclo[3.1.0]hexane-6-carbonylamino)-4-methylpentanoic acid
CID 81451503

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide?
The IUPAC name of N-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide (CID 104872968) is N-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide.
What is the SMILES notation for N-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide?
The canonical SMILES for N-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide is C[C@H](CN)NC(=O)C1C2CCCCC21.
What is the InChIKey of N-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide?
The InChIKey is FCJXHIJGAAVODB-QVNBGCGHSA-N. The full InChI is InChI=1S/C11H20N2O/c1-7(6-12)13-11(14)10-8-4-2-3-5-9(8)10/h7-10H,2-6,12H2,1H3,(H,13,14)/t7-,8?,9?,10?/m1/s1.
What are the key properties of N-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide?
N-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide has a molecular weight of 196.29 g/mol, XLogP of 0.89, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-aminopropan-2-yl]bicyclo[4.1.0]heptane-7-carboxamide is sourced from PubChem (CID 104872968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).