N-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide

C12H21NO — CID 10104124

IUPACN-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide
SMILESCNC(=O)C1(C(C)C)CC2CCC1C2
InChIInChI=1S/C12H21NO/c1-8(2)12(11(14)13-3)7-9-4-5-10(12)6-9/h8-10H,4-7H2,1-3H3,(H,13,14)
InChIKeyUOLGCURSNDPKOP-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.19
Rot. Bonds2

About N-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide

N-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide (PubChem CID 10104124) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is N-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide.

Molecular Properties

Compound NameN-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide
PubChem CID10104124
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC NameN-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide
SMILESCNC(=O)C1(C(C)C)CC2CCC1C2
InChIInChI=1S/C12H21NO/c1-8(2)12(11(14)13-3)7-9-4-5-10(12)6-9/h8-10H,4-7H2,1-3H3,(H,13,14)
InChIKeyUOLGCURSNDPKOP-UHFFFAOYSA-N
XLogP2.19
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide?
The IUPAC name of N-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide (CID 10104124) is N-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide.
What is the SMILES notation for N-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide?
The canonical SMILES for N-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide is CNC(=O)C1(C(C)C)CC2CCC1C2.
What is the InChIKey of N-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide?
The InChIKey is UOLGCURSNDPKOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c1-8(2)12(11(14)13-3)7-9-4-5-10(12)6-9/h8-10H,4-7H2,1-3H3,(H,13,14).
What are the key properties of N-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide?
N-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide has a molecular weight of 195.31 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-propan-2-ylbicyclo[2.2.1]heptane-2-carboxamide is sourced from PubChem (CID 10104124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).