N-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide

C11H18N6O — CID 106626973

IUPACN-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide
SMILESO=C(c1nn[nH]n1)N(CC1CCCCN1)C1CC1
InChIInChI=1S/C11H18N6O/c18-11(10-13-15-16-14-10)17(9-4-5-9)7-8-3-1-2-6-12-8/h8-9,12H,1-7H2,(H,13,14,15,16)
InChIKeyXXCFYPWTMDOJSC-UHFFFAOYSA-N
MW250.31 g/mol
LogP-0.05
Rot. Bonds4

About N-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide

N-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide (PubChem CID 106626973) has the molecular formula C11H18N6O and a molecular weight of 250.31 g/mol. Its IUPAC name is N-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide
PubChem CID106626973
Molecular FormulaC11H18N6O
Molecular Weight250.31 g/mol
Exact Mass250.15
IUPAC NameN-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide
SMILESO=C(c1nn[nH]n1)N(CC1CCCCN1)C1CC1
InChIInChI=1S/C11H18N6O/c18-11(10-13-15-16-14-10)17(9-4-5-9)7-8-3-1-2-6-12-8/h8-9,12H,1-7H2,(H,13,14,15,16)
InChIKeyXXCFYPWTMDOJSC-UHFFFAOYSA-N
XLogP-0.05
TPSA86.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-N-(piperidin-2-ylmethyl)acetamide
CID 66569474
N-cyclopropyl-5-propyl-N-(pyrrolidin-2-ylmethyl)-1H-1,2,4-triazole-3-carboxamide
CID 106599359
N-cyclopropyl-2-oxo-N-(piperidin-2-ylmethyl)-1,3-dihydroimidazole-4-carboxamide
CID 106626866
N-cyclopropyl-N-(piperidin-2-ylmethyl)pyridine-2-carboxamide
CID 106627024
5-chloro-N-cyclopropyl-N-(piperidin-2-ylmethyl)pyridine-2-carboxamide
CID 106626904
N-cyclopropyl-3-hydroxy-N-(piperidin-2-ylmethyl)pyridine-4-carboxamide
CID 106626974
N-cyclopropyl-5-methyl-N-(piperidin-2-ylmethyl)pyridine-3-carboxamide
CID 106626967
4-bromo-N-cyclopropyl-N-(piperidin-2-ylmethyl)-1H-pyrrole-2-carboxamide
CID 106626847
N-cyclopropyl-4-methyl-N-(pyrrolidin-2-ylmethyl)thiadiazole-5-carboxamide
CID 106599443
5-bromo-N-cyclopropyl-N-(piperidin-2-ylmethyl)thiophene-2-carboxamide
CID 106626893
N-cyclopropyl-2,5-dihydroxy-N-(piperidin-2-ylmethyl)benzamide
CID 107725344
N-cyclopropyl-6-oxo-N-(piperidin-2-ylmethyl)pyran-3-carboxamide
CID 106627073

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide?
The IUPAC name of N-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide (CID 106626973) is N-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide?
The canonical SMILES for N-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide is O=C(c1nn[nH]n1)N(CC1CCCCN1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide?
The InChIKey is XXCFYPWTMDOJSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N6O/c18-11(10-13-15-16-14-10)17(9-4-5-9)7-8-3-1-2-6-12-8/h8-9,12H,1-7H2,(H,13,14,15,16).
What are the key properties of N-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide?
N-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide has a molecular weight of 250.31 g/mol, XLogP of -0.05, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(piperidin-2-ylmethyl)-2H-tetrazole-5-carboxamide is sourced from PubChem (CID 106626973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).