N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide

C13H22N2O — CID 120556652

IUPACN-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide
SMILESCC1CNCCC1NC(=O)C1C2CCCC21
InChIInChI=1S/C13H22N2O/c1-8-7-14-6-5-11(8)15-13(16)12-9-3-2-4-10(9)12/h8-12,14H,2-7H2,1H3,(H,15,16)
InChIKeyAWKYSCPKVSVGRY-UHFFFAOYSA-N
MW222.33 g/mol
LogP1.15
Rot. Bonds2

About N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide

N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide (PubChem CID 120556652) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide.

Molecular Properties

Compound NameN-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide
PubChem CID120556652
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC NameN-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide
SMILESCC1CNCCC1NC(=O)C1C2CCCC21
InChIInChI=1S/C13H22N2O/c1-8-7-14-6-5-11(8)15-13(16)12-9-3-2-4-10(9)12/h8-12,14H,2-7H2,1H3,(H,15,16)
InChIKeyAWKYSCPKVSVGRY-UHFFFAOYSA-N
XLogP1.15
TPSA41.13 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 ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methylpiperidin-4-yl)cyclohexanecarboxamide;hydrochloride
CID 120557474
N-(3-methylpiperidin-4-yl)oxane-4-carboxamide
CID 79886712
1-cyclopropyl-3-(3-methylpiperidin-4-yl)urea
CID 79886101
N-(3-methylpiperidin-4-yl)pyrrolidine-1-carboxamide
CID 79886370
N-piperidin-3-ylbicyclo[4.1.0]heptane-7-carboxamide;hydrochloride
CID 119426705
N-(3-methylpiperidin-4-yl)-2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 120556975
4-[(2-cyclopentylacetyl)amino]-N-(3-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 120555118
N-piperidin-4-ylbicyclo[4.1.0]heptane-7-carboxamide;hydrochloride
CID 119388101
1-butanoyl-N-(3-methylpiperidin-4-yl)piperidine-2-carboxamide
CID 120555744
N-(2-methylcyclopropyl)pyrrolidine-3-carboxamide
CID 63006462
N-(3-methylpiperidin-4-yl)-2,3-dihydro-1-benzofuran-2-carboxamide;hydrochloride
CID 120553307
3-cyclopentyl-N-[2-[(3-methylpiperidin-4-yl)amino]-2-oxoethyl]propanamide;hydrochloride
CID 120554749

Frequently Asked Questions

What is the IUPAC name of N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide?
The IUPAC name of N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide (CID 120556652) is N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide.
What is the SMILES notation for N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide?
The canonical SMILES for N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide is CC1CNCCC1NC(=O)C1C2CCCC21.
What is the InChIKey of N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide?
The InChIKey is AWKYSCPKVSVGRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-8-7-14-6-5-11(8)15-13(16)12-9-3-2-4-10(9)12/h8-12,14H,2-7H2,1H3,(H,15,16).
What are the key properties of N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide?
N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide has a molecular weight of 222.33 g/mol, XLogP of 1.15, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylpiperidin-4-yl)bicyclo[3.1.0]hexane-6-carboxamide is sourced from PubChem (CID 120556652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).